SCHEMBL9137156

SCHEMBL9137156

CCc1nc2c(C)cc(C)nc2n1Cc1ccc2c(c1)nc(-c1ccccc1)n2Cc1nnn[nH]1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GPR4 P46093 3/20 0.53
▸ AGTR1 P30556 1/20 0.51
▸ AGTR2 P50052 1/20 0.51

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
SCHEMBL9139089 0.93 GPR4 (0.51) GPR4AGTR1AGTR2
SCHEMBL9563137 0.82 AGTR2 (0.57) GPR4AGTR1AGTR2
SCHEMBL9136697 0.82 GPR4 (0.52) GPR4
SCHEMBL9569267 0.82 — —
Water SCHEMBL9138362 0.81 — —
SCHEMBL8140704 0.79 GPR4 (0.54) GPR4AGTR1AGTR2
SCHEMBL9135706 0.79 — —
SCHEMBL8741166 0.78 AGTR2 (0.61) GPR4AGTR1AGTR2
SCHEMBL8999434 0.78 — —
SCHEMBL9135348 0.77 PPARG (0.58) AGTR1AGTR2

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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