SCHEMBL6436769

SCHEMBL6436769

CC(NC(=O)c1cc2ccccc2n1Cc1cccc(C(N)=S)c1)c1ccncc1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.67
PLA2G10 O15496 1/20 0.51
F2 P00734 2/20 0.46
PHGDH O43175 1/20 0.45
PPARG P37231 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
SCHEMBL6436996 0.83 F10 (0.71) F10PLA2G10F2
SCHEMBL6432886 0.83 F10 (0.56) F10PHGDHPPARG
SCHEMBL6434131 0.82 F10 (0.59) F10PLA2G10F2
SCHEMBL6433340 0.77 F10 (0.85) F10F2
SCHEMBL27497454 0.77 PLA2G10 (0.74) F10PLA2G10F2
SCHEMBL7429684 0.77 F10 (0.59) F10PLA2G10F2
Trifluoroacetic Acid SCHEMBL6435750 0.76 F10 (0.90) F10F2
SCHEMBL7428962 0.75 F10 (0.62) F10PLA2G10F2
Trifluoroacetic Acid SCHEMBL6437370 0.75 F10 (1.00) F10F2
SCHEMBL6435741 0.74 F10 (0.66) F10PLA2G10F2

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
CN-1220681-C Indole derivatives as XA factor inhibitors AVENTIS MEDICINES DEUTSCHLAND (DE) 2005-09-28 CN disclosed
EP-1042287-B1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
US-6337344-B1 ANTICOAGULANTS AND ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-01-08 US disclosed
CN-1283186-A Indole derivatives as XA factor inhibitors AWENTIS MEDICINES DEUTSCHLAND (DE) 2001-02-07 CN disclosed
EP-1042287-A1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA Aventis Pharma Deutschland GmbH (DE) 2000-10-11 EP disclosed
WO-1999033800-A1 INDOLE DERIVATIVES AS INHIBITORS OR FACTOR XA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-08 WO disclosed