SCHEMBL31319759

SCHEMBL31319759

COc1ccnc(-c2c(Cl)ccc3cc[nH]c23)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.49
▸ CCR5 P51681 1/20 0.49
▸ CCR8 P51685 1/20 0.49
▸ SYK P43405 4/20 0.46
▸ MEN1 O00255 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CCNE2 O96020 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ PRKACA P17612 1/20 0.37
▸ PRKACG P22612 1/20 0.37
▸ PRKACB P22694 1/20 0.37
▸ CCND1 P24385 1/20 0.37
▸ CCNE1 P24864 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ NOS3 P29474 1/20 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
SCHEMBL31319703 0.76 CCR1 (0.46) CCR1CCR5CCR8SYKPOLB
SCHEMBL31319561 0.72 CCR1 (0.41) CCR1CCR5CCR8CDK2DYRK1A
SCHEMBL31319558 0.72 CCR1 (0.41) CCR1CCR5CCR8CDK2DYRK1A
SCHEMBL31319716 0.71 CCR1 (0.44) CCR1CCR5CCR8NOS3NOS2
SCHEMBL31438282 0.69 AHR (0.47) DYRK1AAHR
SCHEMBL182529 0.69 CCR1 (1.00) CCR1CCR5CCR8SYKNOS3
SCHEMBL29395249 0.69 CCR1 (1.00) CCR1CCR5CCR8SYKNOS3
SCHEMBL7228502 0.68 CCR1 (0.56) CCR1CCR5CCR8PIK3CAPIK3CB
SCHEMBL31319726 0.68 AHR (0.39) DYRK1AAHR
SCHEMBL12885503 0.68 CCR1 (0.56) CCR1CCR5CCR8POLBPIK3CA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025038863-A1 INDOLE AND PYRROLOYPYRIDINE DERIVATIVES AS GPR17 MODULATORS BIOGEN MA INC. (US) 2025-02-20 — — WO disclosed
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