SCHEMBL31467644

SCHEMBL31467644

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)N1CC2(CN(Cc3cc[nH]c3)C2)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 1/20 0.40
▸ CYP2D6 P10635 2/20 0.34
▸ RORC P51449 7/20 0.34
▸ ADORA2A P29274 4/20 0.34
▸ ADORA2B P29275 4/20 0.34
▸ ADORA1 P30542 3/20 0.34
▸ USP2 O75604 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ BRS3 P32247 5/20 0.33
▸ NR1I2 O75469 1/20 0.32

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
SCHEMBL31467597 0.85 TRPV4 (0.40) TRPV4CYP2D6RORCCYP3A4BRS3
SCHEMBL31467643 0.85 CYP3A4 (0.47) TRPV4CYP2D6USP2CYP3A4
SCHEMBL31467604 0.84 TRPV4 (0.40) TRPV4CYP2D6RORCBRS3NR1I2
SCHEMBL31467598 0.84 TRPV4 (0.41) TRPV4CYP2D6RORCUSP2CYP3A4
SCHEMBL31467620 0.84 TRPV4 (0.41) TRPV4CYP2D6RORCUSP2CYP3A4
SCHEMBL25371906 0.82 TRPV4 (0.44) TRPV4CYP2D6BRS3NR1I2
SCHEMBL30567044 0.82 TRPV4 (0.44) TRPV4CYP2D6BRS3NR1I2
SCHEMBL31467569 0.82 KDM4E (0.42) TRPV4CYP2D6USP2BRS3NR1I2
SCHEMBL31467641 0.81 TRPV4 (0.41) TRPV4CYP2D6RORCUSP2CYP3A4
SCHEMBL31467576 0.80 TRPV4 (0.40) TRPV4CYP2D6RORCBRS3NR1I2

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-2025049275-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2025-03-06 — — WO disclosed
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