SCHEMBL738729

SCHEMBL738729

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C(=O)OCC(O)CO

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.63
DUSP3 P51452 1/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
LMNA P02545 1/20 0.63
DGKA P23743 1/20 0.54
USP2 O75604 1/20 0.51
FAAH O00519 4/20 0.48
GPR84 Q9NQS5 6/20 0.44
CA2 P00918 1/20 0.44
PLA2G2C Q5R387 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43

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
SCHEMBL29118717 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28752404 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28591949 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL28366372 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL21617316 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL21419884 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL29016126 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL14778640 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL9173378 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL252664 1.00 KDM4E (0.63) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2116242-B1 NEW PHARMACEUTICAL COMPOSITION SHENZHEN SALUBRIS PHARM CO LTD (CN) 2016-10-12 EP claimed
US-8138214-B2 Pharmaceutical composition SHANGHAI ALLIST PHARMACEUTICAL, INC. (CN) 2012-03-20 US claimed
US-20090326025-A1 NEW PHARMACEUTICAL COMPOSITION SHENZHEN SALUBRIS PHARMACEUTICALS CO., LTD (CN) 2009-12-31 US claimed
EP-2116242-A1 NEW PHARMACEUTICAL COMPOSITION Shanghai Allist Pharmaceuticals, Inc. (CN) 2009-11-11 EP claimed
CN-117599029-A Compositions for controlled release of cysteamine and systematic treatment of cysteamine-sensitive disorders 硫创治疗公司 2024-02-27 CN disclosed
WO-2023198197-A1 FREE-STATE PLX5622 CRYSTAL FORM AND PREPARATION METHOD THEREFOR 上海皓鸿生物医药科技有限公司 2023-10-19 WO disclosed
US-20160022661-A1 Dosage Form Comprising Crizotinib RATIOPHARM GMBH (DE) 2016-01-28 US disclosed
EP-2968167-A1 DOSAGE FORM COMPRISING CRIZOTINIB ratiopharm GmbH (DE) 2016-01-20 EP disclosed
WO-2014140159-A1 DOSAGE FORM COMPRISING CRIZOTINIB RATIOPHARM GMBH (DE) 2014-09-18 WO disclosed
CN-101022787-B Abuse-resistant oral dosage form comprising (1R,2R) -3- (3-dimethylamino-1-ethyl-2-methyl-propyl) phenol GRUENENTHAL GMBH 2012-01-11 CN disclosed
CN-101835474-A Idarubicin for the treatment of lymphoma in dogs PFIZER PROD INC 2010-09-15 CN disclosed
CN-100355457-C Dispersible pharmaceutical compositions PHARMACIA & UPJOHN CO LLC (US) 2007-12-19 CN disclosed
CN-101022787-A Abuse-resistant oral dosage form comprising (1R, 2R) -3- (3-dimethylamino-1-ethyl-2-methyl-propyl) phenol GRUENENTHAL CHEMIE (DE) 2007-08-22 CN disclosed
CN-1720065-A Dispersible pharmaceutical compositions PHARMACIA & UPJOHN CO LLC (US) 2006-01-11 CN 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 (2 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-20090326025-A1 NEW PHARMACEUTICAL COMPOSITION MYO1G, PEAK1, MYLK2 KDM4E 575/4885DUSP3 3905/4885MEN1 3681/4885
US-20160022661-A1 Dosage Form Comprising Crizotinib ALK, ABL1, FGFR2 KDM4E 1922/4885DUSP3 3854/4885MEN1 238/4885

“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.