SCHEMBL7985574

SCHEMBL7985574

COc1[c]ccc(C(=N)N)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 8/20 0.49
PRSS2 P07478 4/20 0.49
PRSS3 P35030 4/20 0.49
PTGIR P43119 1/20 0.39
PLAU P00749 5/20 0.38
F10 P00742 2/20 0.38
PLG P00747 1/20 0.37
C1S P09871 2/20 0.36

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
SCHEMBL358188 0.81 PARP1 (0.49) PLAU
SCHEMBL7975870 0.81 PRSS1 (0.50) PRSS1PRSS2PRSS3PLAUF10
SCHEMBL7975771 0.79 CA1 (0.30)
SCHEMBL9676481 0.77 CYP1A2 (0.47)
SCHEMBL2422430 0.76 TPMT (0.48)
SCHEMBL221066 0.76 ALDH1A1 (0.42)
SCHEMBL1950632 0.75 PRSS1 (0.50) PRSS1PRSS2PRSS3PLAUF10
SCHEMBL3964444 0.74 CA1 (0.47)
SCHEMBL1743175 0.74 PLAU (0.33) PRSS1PRSS2PRSS3PLAUF10
SCHEMBL8170377 0.74 F2 (0.44) PRSS1PRSS2PRSS3

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-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed