SCHEMBL7400737

SCHEMBL7400737

COc1ccc(Oc2cc(F)cc3[nH]c(Cc4nc5cc(C(=N)N)ccc5[nH]4)nc23)cc1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.70
TPSAB1 Q15661 3/20 0.47
PRSS1 P07477 3/20 0.47
F2 P00734 3/20 0.47
PLG P00747 2/20 0.47
PLAU P00749 2/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
TPSD1 Q9BZJ3 1/20 0.46
TPSG1 Q9NRR2 1/20 0.46
F7 P08709 1/20 0.45
KLK1 P06870 1/20 0.43
KLK5 Q9Y337 1/20 0.43
PLAT P00750 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
SCHEMBL7409928 0.91 F10 (0.64) F10TPSAB1PRSS1F2PLG
SCHEMBL7411798 0.90 F10 (0.85) F10TPSAB1PRSS1F2PLG
SCHEMBL7406130 0.87 F10 (0.70) F10TPSAB1PRSS1F2PLG
SCHEMBL7408623 0.85 F10 (0.55) F10TPSAB1PRSS1F2PLG
SCHEMBL7409111 0.84 F10 (0.56) F10TPSAB1PRSS1F2PLG
SCHEMBL7409477 0.84 F10 (0.68) F10TPSAB1PRSS1F2PLG
SCHEMBL7402007 0.84 F10 (0.54) F10TPSAB1PRSS1F2PLG
SCHEMBL7403210 0.83 F10 (0.67) F10TPSAB1PRSS1F2PLG
SCHEMBL7404354 0.83 F10 (0.53) F10TPSAB1PRSS1F2PLG
SCHEMBL7408212 0.82 F10 (0.66) F10TPSAB1PRSS1F2PLG

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
WO-1999026932-A1 BY AMIDINO GROUP SUBSTITUTED HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTICOAGULANTS AXYS PHARMACEUTICALS, INC. (US) 1999-06-03 WO disclosed