SCHEMBL6595675

SCHEMBL6595675

COC(=O)c1scc(CN2CCSCC2)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.52
F2 P00734 7/20 0.43
CYP2A13 Q16696 1/20 0.41
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL6590035 0.87 HCRTR1 (0.54) F10F2CYP2A13HCRTR1HCRTR2
SCHEMBL6592233 0.87 F10 (0.54) F10F2HCRTR1HCRTR2KDM4E
SCHEMBL6590805 0.82 F10 (0.52) F10F2CYP2A13POLBKDM4E
SCHEMBL6590808 0.81 F10 (0.51) F10F2CYP2A13POLBKDM4E
SCHEMBL27457202 0.77 HCRTR1 (0.40) F10F2HCRTR1HCRTR2KDM4E
SCHEMBL6587977 0.75 KMT2A (0.39) F10POLBKDM4EMEN1KMT2A
SCHEMBL6591889 0.75 KMT2A (0.39) F10POLBKDM4EMEN1KMT2A
SCHEMBL27595508 0.74 F10 (0.42) F10F2POLBKDM4EMEN1
SCHEMBL3306728 0.74 KMT2A (0.41) F10POLBKDM4EMEN1KMT2A
SCHEMBL27472593 0.72 KMT2A (0.40) F10POLBKDM4EMEN1KMT2A

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