SCHEMBL7406196

SCHEMBL7406196

Cn1c(Cc2nc3cc(C(=N)N)ccc3[nH]2)nc2cc(Cl)ccc21

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.56
F2 P00734 7/20 0.48
TPSAB1 Q15661 3/20 0.48
PRSS1 P07477 2/20 0.48
PLG P00747 1/20 0.48
PLAU P00749 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
TPSD1 Q9BZJ3 1/20 0.47
TPSG1 Q9NRR2 1/20 0.47
F7 P08709 1/20 0.47
KLK1 P06870 1/20 0.44
KLK5 Q9Y337 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
SCHEMBL7408823 0.92 F10 (0.59) F10F2TPSAB1PRSS1PLG
SCHEMBL7404219 0.86 F10 (0.64) F10F2TPSAB1PRSS1PLG
SCHEMBL7402998 0.86 F10 (0.58) F10F2TPSAB1PRSS1PLG
SCHEMBL7406863 0.84 F10 (0.76) F10F2TPSAB1PRSS1PLG
SCHEMBL7405869 0.84 F2 (0.49) F10F2TPSAB1PRSS1PLG
SCHEMBL7406179 0.84 F10 (0.57) F10F2TPSAB1PRSS1PLG
SCHEMBL7409913 0.81 F10 (0.52) F10F2TPSAB1PRSS1PLG
SCHEMBL7477342 0.80 F10 (0.64) F10F2TPSAB1PRSS1PLG
SCHEMBL7476975 0.79 F2 (0.50) F10F2TPSAB1PRSS1PLG
SCHEMBL7409773 0.78 SMN1; SMN2 (0.47) F2

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