SCHEMBL9136697

SCHEMBL9136697

CCc1nc2c(C)cc(C)nc2n1Cc1ccc2c(c1)nc(-c1ccccc1)n2CC#N

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GPR4 P46093 2/20 0.52

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
SCHEMBL9137989 0.93 GPR4 (0.50) GPR4
Water SCHEMBL9138362 0.86 — —
SCHEMBL9569267 0.85 — —
SCHEMBL9135706 0.82 — —
SCHEMBL9137156 0.82 GPR4 (0.53) GPR4
SCHEMBL13743046 0.79 AGTR1 (0.66) —
SCHEMBL9563125 0.79 AGTR1 (0.57) GPR4
SCHEMBL14409680 0.76 — —
SCHEMBL8999099 0.76 — —
SCHEMBL9140028 0.75 PPARG (0.62) —

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-5459147-A Angeotensin-antagonistic effects; hypotensive, antiischemic, and antidiabetic agents, treating glaucoma DR. KARL THOMAE GMBH (DE) 1995-10-17 — — US disclosed
EP-0560330-A2 Substituted benzimidazolyl derivatives, therapeutic agents containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1993-09-15 — — EP disclosed
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