SCHEMBL31319712

SCHEMBL31319712

Clc1ccc2cc[nH]c2c1-c1cccnn1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.42
▸ TNF P01375 1/20 0.37
▸ RIPK1 Q13546 1/20 0.37
▸ SLC6A2 P23975 2/20 0.34
▸ SLC6A4 P31645 2/20 0.34
▸ SLC6A3 Q01959 2/20 0.34
▸ AXL P30530 1/20 0.32
▸ NUDT1 P36639 1/20 0.32
▸ GRM5 P41594 1/20 0.31

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 0.81 CCR1 (0.46) AHRTNFRIPK1AXLNUDT1
SCHEMBL30741488 0.74 AHR (0.43) AHRAXLNUDT1
SCHEMBL31438282 0.74 AHR (0.47) AHRTNFRIPK1AXLNUDT1
SCHEMBL31438285 0.70 AHR (0.50) AHRTNFRIPK1SLC6A2SLC6A4
SCHEMBL30752372 0.70 NOTUM (0.41) AHRTNFRIPK1
SCHEMBL30752361 0.70 AHR (0.39) AHRTNFRIPK1
SCHEMBL31319716 0.70 CCR1 (0.44) AHRTNFRIPK1AXLGRM5
SCHEMBL31319726 0.70 AHR (0.39) AHRTNFRIPK1
SCHEMBL31319636 0.69 PRMT5 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL31319759 0.68 CCR1 (0.49) AHR

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
CN-119585257-A Novel 7-substituted indole sulfonamide derivatives 豪夫迈·罗氏有限公司 2025-03-07 — — CN disclosed
WO-2025038863-A1 INDOLE AND PYRROLOYPYRIDINE DERIVATIVES AS GPR17 MODULATORS BIOGEN MA INC. (US) 2025-02-20 — — WO disclosed
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