SCHEMBL6846428

SCHEMBL6846428

CCC(c1cnccc1N)n1c(C)cnc(NCC(F)(F)c2ccccc2)c1=O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 20/20 0.49
PRSS1 P07477 9/20 0.46
PRSS2 P07478 5/20 0.44
PRSS3 P35030 5/20 0.44
F10 P00742 2/20 0.44
PLAT P00750 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
SCHEMBL4906583 0.75 F2 (0.52) F2PRSS1PRSS2PRSS3F10
SCHEMBL7737891 0.72 F2 (0.54) F2PRSS1PRSS2PRSS3F10
SCHEMBL4904924 0.69 F2 (0.67) F2PRSS1PRSS2PRSS3F10
SCHEMBL14281097 0.68 F2 (0.68) F2PRSS1PRSS2PRSS3F10
SCHEMBL6846360 0.68 F2 (0.58) F2PRSS1PRSS2PRSS3F10
SCHEMBL7448903 0.68 F2 (0.60) F2PRSS1PRSS2PRSS3F10
SCHEMBL6846386 0.68 F2 (0.55) F2PRSS1PRSS2PRSS3F10
SCHEMBL4898740 0.67 F2 (0.63) F2PRSS1PRSS2PRSS3F10
SCHEMBL7066282 0.67 F2 (0.58) F2PRSS1PRSS2PRSS3F10
SCHEMBL6850252 0.66 F2 (0.56) F2PRSS1PRSS2PRSS3F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed