SCHEMBL6594409

SCHEMBL6594409

COC(=O)c1scc(COS(C)(=O)=O)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
KMT2A Q03164 3/20 0.40
F10 P00742 3/20 0.38
F2 P00734 1/20 0.36
GAA P10253 1/20 0.35
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
HTR1A P08908 1/20 0.34
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
PKM P14618 1/20 0.34
EDNRA P25101 1/20 0.34
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL27595508 0.83 F10 (0.42) KDM4EKMT2AF10F2MAPT
SCHEMBL6593708 0.79 F10 (0.38) KDM4EKMT2AF10F2GAA
SCHEMBL6591889 0.79 KMT2A (0.39) KDM4EKMT2AF10MAPTCYP1A2
SCHEMBL6587977 0.79 KMT2A (0.39) KDM4EKMT2AF10GAAMAPT
SCHEMBL3306728 0.77 KMT2A (0.41) KDM4EKMT2AF10GAAMAPT
SCHEMBL6595088 0.75 KDM4E (0.40) KDM4EKMT2AF10GAAMAPT
SCHEMBL27472593 0.75 KMT2A (0.40) KDM4EKMT2AF10GAAMAPT
SCHEMBL4837886 0.74 F2 (0.39) KDM4EKMT2AF10F2MAPT
SCHEMBL6587446 0.74 CYP2A6 (0.37) KDM4EKMT2AF10MAPTCYP1A2
SCHEMBL27139900 0.71 KDM4E (0.51) KDM4EKMT2AGAAMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1040108-B1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AG (DE) 2004-02-25 EP disclosed
US-6498185-B1 ENZYME FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. 2002-12-24 US disclosed
US-6380221-B1 FOR THERAPY OF DISEASE-STATES CHARACTERIZED BY THROMBOTIC ACTIVITY BERLEX LABORATORIES, INC. 2002-04-30 US disclosed
US-6140351-A FOR TREATING THROMBOSIS BERLEX LABORATORIES, INC. (US) 2000-10-31 US disclosed
EP-1040108-A1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-10-04 EP disclosed
WO-1999032477-A1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AKTIENGESELLSCHAFT (DE) 1999-07-01 WO disclosed