SCHEMBL9254271

SCHEMBL9254271

COC(=O)CCc1cn(-c2ccc(-c3ccc(C(=N)N)cc3C)nn2)cn1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.33
TMPRSS2 O15393 1/20 0.33
HTR1D P28221 1/20 0.33
SLC6A4 P31645 1/20 0.33
TMPRSS15 P98073 9/20 0.33
F10 P00742 6/20 0.32
PRSS1 P07477 4/20 0.32
F2 P00734 4/20 0.32
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

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
SCHEMBL9258452 0.91 PRSS1 (0.36) TMPRSS2HTR1DSLC6A4TMPRSS15F10
SCHEMBL9252815 0.90 TMPRSS15 (0.39) TMPRSS15F10PRSS1F2
SCHEMBL9257720 0.90 ITGB3 (0.33) F10PRSS1F2PRSS2PRSS3
SCHEMBL8863938 0.86 TMPRSS15 (0.36) TMPRSS15F10PRSS1F2
SCHEMBL9259497 0.86 KDM5A (0.35) TMPRSS15F10PRSS1F2
SCHEMBL9255214 0.86 CYP46A1 (0.33)
SCHEMBL9251004 0.83 PRSS1 (0.37) TMPRSS15F10PRSS1F2
SCHEMBL9251525 0.81 MIF (0.37) TMPRSS15
SCHEMBL9568428 0.80 TMPRSS15 (0.34) TMPRSS15F10PRSS1F2
SCHEMBL9255073 0.79 PIK3CA (0.32) F10F2

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