SCHEMBL9256872

SCHEMBL9256872

N=C(N)c1ccc(-c2ccc(-n3cnc(CCC(=O)O)c3)nn2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TMPRSS15 P98073 9/20 0.35
ITGB3 P05106 3/20 0.33
ITGA2B P08514 3/20 0.33
F2 P00734 6/20 0.32
PRSS1 P07477 4/20 0.32
F10 P00742 2/20 0.32

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
SCHEMBL9252815 0.89 TMPRSS15 (0.39) TMPRSS15F2PRSS1F10
SCHEMBL9257720 0.89 ITGB3 (0.33) ITGB3ITGA2BF2PRSS1F10
SCHEMBL9251004 0.87 PRSS1 (0.37) TMPRSS15ITGB3ITGA2BF2PRSS1
SCHEMBL9568440 0.84 ITGB3 (0.39) TMPRSS15ITGB3ITGA2BF2PRSS1
SCHEMBL9251805 0.81 PDK1 (0.33)
SCHEMBL9254271 0.79 SYK (0.33) TMPRSS15F2PRSS1F10
SCHEMBL9258452 0.79 PRSS1 (0.36) TMPRSS15F2PRSS1F10
SCHEMBL9253978 0.79 ITGB3 (0.37) TMPRSS15ITGB3ITGA2BF2PRSS1
SCHEMBL9250967 0.76 MAP4K4 (0.41) TMPRSS15ITGB3ITGA2BF2PRSS1
SCHEMBL9259497 0.74 KDM5A (0.35) TMPRSS15F2PRSS1F10

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
US-5463071-A Tetrazole derivatives; useful for inhibiting undesirable cell aggregation DR. KARL THOMAE GMBH (DE) 1995-10-31 US disclosed
EP-0525629-A2 5-membered heterocycles, process for their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1993-02-03 EP disclosed