SCHEMBL7409090

SCHEMBL7409090

N=C(N)c1ccc2[nH]c(Cc3nc4c(Oc5cccc(N6CCOCC6)c5)cc(F)cc4[nH]3)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.53
F2 P00734 2/20 0.40
F7 P08709 1/20 0.40
TPSAB1 Q15661 3/20 0.39
PRSS1 P07477 2/20 0.39
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
TPSD1 Q9BZJ3 1/20 0.39
TPSG1 Q9NRR2 1/20 0.39
BRAF P15056 1/20 0.37

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
SCHEMBL7408623 0.85 F10 (0.55) F10F2F7TPSAB1PRSS1
SCHEMBL7409928 0.84 F10 (0.64) F10F2F7TPSAB1PRSS1
SCHEMBL7406461 0.83 F10 (0.56) F10F2F7TPSAB1PRSS1
SCHEMBL7404354 0.82 F10 (0.53) F10F2F7TPSAB1PRSS1
SCHEMBL7409111 0.80 F10 (0.56) F10F2F7TPSAB1PRSS1
SCHEMBL7400737 0.79 F10 (0.70) F10F2F7TPSAB1PRSS1
SCHEMBL7406130 0.78 F10 (0.70) F10F2F7TPSAB1PRSS1
SCHEMBL7411798 0.77 F10 (0.85) F10F2F7TPSAB1PRSS1
SCHEMBL7402007 0.77 F10 (0.54) F10F2F7TPSAB1PRSS1
SCHEMBL7516744 0.75 F10 (0.58) F10F2F7TPSAB1PRSS1

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