SCHEMBL4333679

SCHEMBL4333679

C=CCc1cc(=O)oc2c(CC=C)c(O)ccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 2/20 0.61
KDM4E B2RXH2 7/20 0.52
GLA P06280 6/20 0.52
GAA P10253 5/20 0.52
MCL1 Q07820 2/20 0.51
ALDH1A1 P00352 6/20 0.49
HPGD P15428 6/20 0.49
ERAP1 Q9NZ08 2/20 0.49
KMT2A Q03164 2/20 0.49
ATM Q13315 1/20 0.49
MEN1 O00255 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CA9 Q16790 1/20 0.48
HIF1A Q16665 2/20 0.47
MAOB P27338 1/20 0.47
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
ERN1 O75460 2/20 0.46

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
SCHEMBL28219087 0.87 MAOB (0.47) SRD5A1KDM4EGLAGAAMCL1
SCHEMBL3878331 0.84 CA9 (0.65) SRD5A1KDM4EGLAGAAMCL1
Hydrazine SCHEMBL28219088 0.82 ESR1 (0.60) KDM4EGLAGAAMCL1ALDH1A1
SCHEMBL11374555 0.81 KDM4E (0.64) SRD5A1KDM4EGLAGAAMCL1
SCHEMBL4342801 0.81 KDM4E (0.67) SRD5A1KDM4EGLAGAAMCL1
SCHEMBL8179535 0.80 ALDH1A1 (0.67) SRD5A1KDM4EMCL1ALDH1A1HPGD
SCHEMBL4484990 0.76 AURKA (0.48) KDM4EGLAGAAMCL1ALDH1A1
SCHEMBL29074526 0.76 SRD5A1 (1.00) SRD5A1KDM4EMCL1ALDH1A1HPGD
SCHEMBL11096994 0.76 SRD5A1 (0.49) SRD5A1KDM4EGLAGAAALDH1A1
SCHEMBL739294 0.74 HSD17B3 (0.68) KDM4EGLAGAAMCL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018307-B2 Process for producing a glucuronide and genetically modified microorganisms useful in this process UTAH STATE UNIVERSITY (US) 2024-06-25 US disclosed
US-20230142611-A1 PROCESS FOR PRODUCING A GLUCURONIDE AND GENETICALLY MODIFIED MICROORGANISMS USEFUL IN THIS PROCESS UTAH STATE UNIVERSITY (US) 2023-05-11 US disclosed
US-20090326056-A1 NOVEL ACTIVES AGAINST PROSTATE CARCINOMA DSM IP ASSETS B.V. (NL) 2009-12-31 US disclosed
EP-0840781-B1 METHODS AND DEVICES FOR THE REMOVAL OF PSORALENS FROM BLOOD PRODUCTS CERUS CORP (US) 2009-12-09 EP disclosed
EP-1584622-B1 Compounds for the photodecontamination of pathogens in blood CERUS CORP (US) 2009-11-11 EP disclosed
EP-1569628-B1 NOVEL USE OF LYCOPENE FOR THE TREATMENT OF DISEASES ASSOCIATED WITH ANDROGEN SIGNALLING DSM IP ASSETS BV (NL) 2009-07-22 EP disclosed
EP-2020997-A2 NOVEL ACTIVES AGAINST PROSTATE CARCINOMA DSMIP Assets B.V. (NL) 2009-02-11 EP disclosed
EP-1898897-A2 METHODS AND RELATED COMPOSITIONS FOR TREATING OR PREVENTING OBESITY, INSULIN RESISTANCE DISORDERS, AND MITOCHONDRIAL-ASSOCIATED DISORDERS Sirtris Pharmaceuticals, Inc. (US) 2008-03-19 EP disclosed
WO-2007131767-A2 NOVEL ACTIVES AGAINST PROSTATE CARCINOMA DSM IP ASSETS B.V. (NL) 2007-11-22 WO disclosed
US-20070149466-A1 Methods and related compositions for treating or preventing obesity, insulin resistance disorders, and mitochondrial-associated disorders SIRTRIS PHARMACEUTICALS, INC. 2007-06-28 US disclosed
WO-1996040857-A1 METHODS AND DEVICES FOR THE REMOVAL OF PSORALENS FROM BLOOD PRODUCTS CERUS CORPORATION (US) 1996-12-19 WO disclosed
US-5585503-A PSORALEN COMPOUNDS STERITECH, INC. (US) 1996-12-17 US disclosed
US-5578736-A SUBSTITUTED PSORALENS STERITECH, INC. (US) 1996-11-26 US disclosed
US-5556993-A PSORALEN COMPOUNDS FOR DEACTIVATION OF HEPATITIS AND HIVVIRUSES STERITECH, INC. (US) 1996-09-17 US disclosed
WO-1996014739-A1 COMPOUNDS FOR THE PHOTODECONTAMINATION OF PATHOGENS IN BLOOD CERUS CORPORATION (US) 1996-05-23 WO disclosed
EP-0707476-A1 COMPOUNDS FOR THE PHOTODECONTAMINATION OF PATHOGENS IN BLOOD STERITECH, INC (US) 1996-04-24 EP disclosed
US-5399719-A 4'-/4-Amino-2-oxa/butyl-4,5',8-trimethylpsoralen; preparation of 4'-/omega-amino-2-oxa/alkyl-4,5',8-trimethylpsoralens by reacting analogous omega-hydroxy compound with methanesulfonyl chloride and base, with sodium azide, with reducing agent STERITECH, INC. (US) 1995-03-21 US disclosed
WO-1995000141-A1 COMPOUNDS FOR THE PHOTODECONTAMINATION OF PATHOGENS IN BLOOD STERITECH, INC. (US) 1995-01-05 WO disclosed
US-4294847-A 8-Aminoalkyl-4-alkylisopsoralens THOMAS C. ELDER, INC. (US) 1981-10-13 US disclosed
US-4294822-A 5-Aminoalkyl-4,4,8-trialkylpsoralens THOMAS C. ELDER, INC. (US) 1981-10-13 US 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 (3 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-20230142611-A1 PROCESS FOR PRODUCING A GLUCURONIDE AND GENETICALLY MODIFIED MICROORGANISMS USEFUL IN THIS PROCESS GUSB, UGT1A4, UGT1A6 SRD5A1 1287/4885KDM4E 1352/4885GLA 94/4885
US-12018307-B2 Process for producing a glucuronide and genetically modified microorganisms useful in this process GUSB, UGT1A4, UGT1A6 SRD5A1 1287/4885KDM4E 1352/4885GLA 94/4885
US-20070149466-A1 Methods and related compositions for treating or preventing obesity, insulin resistance disorders, and mitochondrial-associated disorders SIRT1, SIRT3, SIRT2 SRD5A1 2602/4885KDM4E 2018/4885GLA 1759/4885

“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.