SCHEMBL31319630

SCHEMBL31319630

O=S(=O)(Cl)c1cn(S(=O)(=O)c2ccccc2)c2cc(C(F)(F)F)ccc12

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 16/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ KIF11 P52732 1/20 0.40
▸ PPARG P37231 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HTT P42858 1/20 0.38

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
SCHEMBL20354867 0.83 HTR6 (0.55) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL29365123 0.83 HTR6 (0.55) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL29365118 0.83 HTR6 (0.55) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL28920285 0.83 HTR6 (0.44) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL21596675 0.82 L3MBTL1 (0.47) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL30991290 0.82 L3MBTL1 (0.47) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL16698228 0.82 HTR6 (0.43) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL21596702 0.81 TRPV4 (0.43) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL30991307 0.81 TRPV4 (0.43) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL22864566 0.81 HTR6 (0.60) HTR6CYP3A4LMNASMN1; SMN2

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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