SCHEMBL690131

SCHEMBL690131

COc1ccc2c(c1)[nH]c1cc(OCc3ccccc3)c(C)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.53
MAPT P10636 2/20 0.53
ATM Q13315 1/20 0.53
CTSV O60911 3/20 0.51
CTSL P07711 3/20 0.51
MAOA P21397 2/20 0.51
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
MAOB P27338 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GABRA1 P14867 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA3 P34903 1/20 0.45
GABRA2 P47869 1/20 0.45
ABCB1 P08183 2/20 0.44
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44

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
SCHEMBL7256169 0.85 CTSV (0.66) KDM4EMAPTCTSVCTSLMAOA
SCHEMBL6743988 0.83 CTSV (0.64) KDM4EMAPTCTSVCTSLMAOA
SCHEMBL690576 0.81 MAOA (0.59) KDM4EMAPTCTSVCTSLMAOA
SCHEMBL17817109 0.81 KDM4E (0.69) KDM4EMAPTATMMAOAALDH1A1
SCHEMBL12646131 0.81 KDM4E (0.50) KDM4EMAPTATMMAOAALDH1A1
SCHEMBL16450986 0.81 MAOA (0.55) KDM4ECTSVCTSLMAOAALDH1A1
SCHEMBL18487330 0.80 MAOA (0.57) KDM4ECTSVCTSLMAOAALDH1A1
SCHEMBL14196709 0.80 MAPT (0.44) KDM4EMAPTATMCTSVCTSL
SCHEMBL13424610 0.78 KDM4E (0.47) KDM4EMAPTATMMAOAALDH1A1
SCHEMBL7255064 0.76 MAOA (0.64) CTSVCTSLMAOAALDH1A1HPGD

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10457639-B2 Fluorescent regulators of RASSF1A expression and human cancer cell proliferation GEORGETOWN UNIVERSITY (US) 2019-10-29 US disclosed
US-10266490-B2 Radioprotector compounds GEORGETOWN UNIVERSITY (US) 2019-04-23 US disclosed
US-20150044293-A1 RADIOPROTECTOR COMPOUNDS GEORGETOWN UNIVERSITY (US) 2015-02-12 US disclosed
EP-2484666-A1 Fluorescent regulators of RASSF1A expression and human cancer cell proliferation Georgetown University (US) 2012-08-08 EP disclosed
EP-2323982-B1 FLUORESCENT REGULATORS OF RASSF1A EXPRESSION AND HUMAN CANCER CELL PROLIFERATION UNIV GEORGETOWN (US) 2012-02-29 EP disclosed
US-20110152339-A1 FLUORESCENT REGULATORS OF RASSF1A EXPRESSION AND HUMAN CANCER CELL PROLIFERATION GEORGETOWN UNIVERSITY 2011-06-23 US disclosed
EP-2323982-A1 FLUORESCENT REGULATORS OF RASSF1A EXPRESSION AND HUMAN CANCER CELL PROLIFERATION Georgetown University (US) 2011-05-25 EP disclosed
US-20100130579-A1 CANCER THERAPY GEORGETOWN UNIVERSITY (US) 2010-05-27 US disclosed
WO-2010019271-A1 FLUORESCENT REGULATORS OF RASSF1A EXPRESSION AND HUMAN CANCER CELL PROLIFERATION GEORGETOWN UNIVERSITY (US) 2010-02-18 WO disclosed
WO-2008051523-A2 CARBAZOLE DERIVATIVES USEFUL AS MEDICAMENTS IN CANCER THERAPY GEORGETOWN UNIVERSITY (US) 2008-05-02 WO disclosed

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

For each of this compound's patents that has machine-readable text (5 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-20110152339-A1 FLUORESCENT REGULATORS OF RASSF1A EXPRESSION AND HUMAN CANCER CELL PROLIFERATION RASSF5, RASSF2, MKI67 KDM4E 1073/4885MAPT 4658/4885ATM 3697/4885
US-10266490-B2 Radioprotector compounds DDB1, CASP3, BAD KDM4E 1496/4885MAPT 4589/4885ATM 420/4885
US-20100130579-A1 CANCER THERAPY RASSF5, RASSF2, DNMT1 KDM4E 331/4885MAPT 3975/4885ATM 2478/4885
US-20150044293-A1 RADIOPROTECTOR COMPOUNDS DDB1, CASP3, BAD KDM4E 1496/4885MAPT 4589/4885ATM 420/4885
US-10457639-B2 Fluorescent regulators of RASSF1A expression and human cancer cell proliferation RASSF5, RASSF2, MKI67 KDM4E 1073/4885MAPT 4658/4885ATM 3697/4885

“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.