SCHEMBL7488491

SCHEMBL7488491

CCn1c(CC[C@@H]2CCCN2C(=O)CN2CCCCC2C(=O)O)cc2ccc(C(=N)N)cc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 7/20 0.37
▸ F10 P00742 1/20 0.37
▸ PRSS1 P07477 9/20 0.36
▸ TMPRSS15 P98073 7/20 0.36
▸ ITGB3 P05106 2/20 0.34
▸ ITGA2B P08514 2/20 0.34
▸ SPHK1 Q9NYA1 3/20 0.33
▸ SPHK2 Q9NRA0 2/20 0.33

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
SCHEMBL7486288 0.98 F2 (0.38) F2F10PRSS1TMPRSS15SPHK1
SCHEMBL7492363 0.92 KDM4E (0.41) F2F10PRSS1
SCHEMBL7490136 0.90 ALDH1A1 (0.39) F2F10PRSS1TMPRSS15SPHK1
SCHEMBL7495849 0.89 F2 (0.37) F2F10PRSS1TMPRSS15ITGB3
SCHEMBL7484602 0.89 F2 (0.37) F2F10PRSS1TMPRSS15ITGB3
SCHEMBL7491298 0.87 F2 (0.38) F2F10PRSS1TMPRSS15ITGB3
SCHEMBL7485043 0.86 F2 (0.37) F2F10PRSS1TMPRSS15SPHK1
SCHEMBL7487357 0.85 F2 (0.36) F2F10PRSS1TMPRSS15SPHK1
SCHEMBL7492740 0.85 F2 (0.38) F2F10PRSS1TMPRSS15SPHK1
SCHEMBL7447646 0.85 F2 (0.39) F2F10PRSS1TMPRSS15ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0918768-B1 AROMATIC AMIDINE DERIVATIVES USEFUL AS SELECTIVE THROMBIN INHIBITORS C & C RES LAB (KR) 2002-01-09 — — EP disclosed
US-6201006-B1 ANTICOAGULANTS C & C RESEARCH LABORATORIES (KR) 2001-03-13 — — US disclosed
Send feedback