SCHEMBL1120978

SCHEMBL1120978

CCOC(=O)Oc1c2[nH]c3ccccc3c2cc2c1[nH]c1ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.52
ALDH1A1 P00352 4/20 0.52
MAPT P10636 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 1/20 0.52
HCRTR1 O43613 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
ERAP1 Q9NZ08 1/20 0.48
LMNA P02545 3/20 0.48
GABRP O00591 2/20 0.48
GABRD O14764 2/20 0.48
GABRA1 P14867 2/20 0.48
GABRB1 P18505 2/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
GABRA5 P31644 2/20 0.48
GABRA3 P34903 2/20 0.48
GABRA2 P47869 2/20 0.48
GABRB2 P47870 2/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3197163 0.84 KDM4E (0.41) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL3199599 0.83 GABRA1 (0.48) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL12852234 0.82 KDM4E (0.41) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL1120941 0.82 KDM4E (0.61) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL21043624 0.82 KDM4E (0.60) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL12813732 0.80 ALDH1A1 (0.62) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL3207259 0.79 KDM4E (0.45) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL3202953 0.77 GABRP (0.53) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL30004235 0.77 TSHR (0.48) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL19583350 0.77 TSHR (0.48) KDM4EALDH1A1MAPTMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200179337-A1 MEANS FOR TREATING SEXUALLY TRANSMITTED INFECTIONS AKTSIONERNOE OBSCHESTVO "VELES FARMA" (RU) 2020-06-11 US claimed
EP-2694057-B1 LIPOXYGENASE INHIBITORS STANFORD RES INST INT (US) 2019-06-05 EP claimed
US-9663462-B2 Anti-parasitic methods and compositions utilizing diindolylmethane-related indoles BIORESPONSE, L.L.C. (US) 2017-05-30 US claimed
US-9353058-B2 Anti-parasitic methods and compositions utilizing diindolylmethane-related indoles BIORESPONSE, L.L.C. (US) 2016-05-31 US claimed
US-20160101083-A1 ANTI-PARASITIC METHODS AND COMPOSITIONS UTILIZING DIINDOLYLMETHANE-RELATED INDOLES BIORESPONSE, L.L.C. (US) 2016-04-14 US claimed
WO-2015042170-A1 COMPOSITIONS AND USES OF COMBINATIONS OF DIM-RELATED INDOLES AND SELECTED ANTI-ANDROGEN COMPOUNDS WAYNE STATE UNIVERSITY (US) 2015-03-26 WO claimed
US-20140037577-A1 ANTI-PARASITIC METHODS AND COMPOSITIONS UTILIZING DIINDOLYLMETHANE-RELATED INDOLES BIORESPONSE, L.L.C. 2014-02-06 US claimed
US-8586621-B2 Anti-parasitic methods and compositions utilizing diindolylmethane-related indoles BIORESPONSE, L.L.C. 2013-11-19 US claimed
US-8552052-B2 Use of diindolylmethane-related indoles for the treatment and prevention of respiratory syncytial virus associated conditions BIORESPONSE, L.L.C. (US) 2013-10-08 US claimed
US-20110250267-A1 USE OF DIINDOLYLMETHANE-RELATED INDOLES FOR THE TREATMENT AND PREVENTION OF RESPIRATORY SYNCYTIAL VIRUS ASSOCIATED CONDITIONS BIORESPONSE, L.L.C. 2011-10-13 US claimed
EP-1865929-A2 DIINDOLYLMETHANE-BASED COMPOSITIONS AND METHODS OF USE THEREOF FOR PROMOTING ORAL MUCOSAL AND BONE HEALTH Bioresponse, L.L.C. (US) 2007-12-19 EP claimed
EP-1838303-A2 USE OF DIINDOLYLMETHANE-RELATED INDOLES FOR THE TREATMENT AND PREVENTION OF RESPIRATORY SYNCYTIAL VIRUS ASSOCIATES CONDITIONS Bioresponse LLC (US) 2007-10-03 EP claimed
US-20060264497-A1 Diindolylmethane-based compositions and methods of use thereof for promoting oral mucosal and bone health BIORESPONSE, L.L.C. 2006-11-23 US claimed
WO-2006105196-A2 DIINDOLYLMETHANE-BASED COMPOSITIONS AND METHODS OF USE THEREOF FOR PROMOTING ORAL MUCOSAL AND BONE HEALTH BIORESPONSE, L.L.C. (US) 2006-10-05 WO claimed
WO-2006083458-A2 USE OF DIINDOLYLMETHANE-RELATED INDOLES FOR THE TREATMENT AND PREVENTION OF RESPIRATORY SYNCYTIAL VIRUS ASSOCIATES CONDITIONS BIORESPONSE LLC (US) 2006-08-10 WO claimed
US-20060111423-A1 Use of diindolylmethane-related indoles and growth factor receptor inhibitors for the treatment of human cytomegalovirus-associated disease BIORESPONSE, L.L.C. 2006-05-25 US claimed
WO-2006047716-A2 USE OF DIINDOLYLMETHANE-RELATED INDOLES AND GROWTH FACTOR RECEPTOR INHIBITORS FOR THE TREATMENT OF HUMAN CYTOMEGALOVIRUS ASSOCIATED DISEASE BIORESPONSE LLC (US) 2006-05-04 WO claimed
US-20050267193-A1 Diindolylmethane formulations for the treatment of leiomyomas BIORESPONSE, LLC 2005-12-01 US claimed
WO-2005107747-A2 DIINDOLYMETHANE FORMULATIONS FOR THE TREATMENT OF LEIOMYOMAS BIORESPONSE, LLC (US) 2005-11-17 WO claimed
US-20050063903-A1 cruciferous-related indole particulary diindolylmethanes, zinc/iron chelator, and optionally one or more of a zinc-binding histone deacetylase inhibitor, gallium or an EGFR antagonist, are administered simultaneously BIORESPONSE L.L.C. 2005-03-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160101083-A1 ANTI-PARASITIC METHODS AND COMPOSITIONS UTILIZING DIINDOLYLMETHANE-RELATED INDOLES CASP3, IDO1, INMT KDM4E 3429/4885ALDH1A1 4436/4885MAPT 4079/4885
US-20140037577-A1 ANTI-PARASITIC METHODS AND COMPOSITIONS UTILIZING DIINDOLYLMETHANE-RELATED INDOLES CASP3, IDO1, INMT KDM4E 3429/4885ALDH1A1 4436/4885MAPT 4079/4885
US-20110250267-A1 USE OF DIINDOLYLMETHANE-RELATED INDOLES FOR THE TREATMENT AND PREVENTION OF RESPIRATORY SYNCYTIAL VIRUS ASSOCIATED CONDITIONS EGFR, IDO1, IDO2 KDM4E 2784/4885ALDH1A1 3609/4885MAPT 2649/4885
US-20060264497-A1 Diindolylmethane-based compositions and methods of use thereof for promoting oral mucosal and bone health HPGDS, IDO1, IDO2 KDM4E 1103/4885ALDH1A1 2982/4885MAPT 4397/4885
US-20060111423-A1 Use of diindolylmethane-related indoles and growth factor receptor inhibitors for the treatment of human cytomegalovirus-associated disease EGFR, IGF1R, MIF KDM4E 2458/4885ALDH1A1 1897/4885MAPT 3004/4885
US-20050267193-A1 Diindolylmethane formulations for the treatment of leiomyomas IDO1, IDO2, EDNRA KDM4E 1025/4885ALDH1A1 2672/4885MAPT 4268/4885
US-20050063903-A1 cruciferous-related indole particulary diindolylmethanes, zinc/iron chelator, and optionally one or more of a zinc-binding histone deacetylase inhibitor, gallium or an EGFR antagonist, are administered simultaneously EZH2, EGFR, ZKSCAN2 KDM4E 435/4885ALDH1A1 4363/4885MAPT 1095/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.