SCHEMBL31467616

SCHEMBL31467616

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)N1CC2(CN(Cc3cnc(C)n3C)C2)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 3/20 0.39
▸ RORC P51449 5/20 0.33
▸ PDE5A O76074 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ BRS3 P32247 5/20 0.31
▸ NR1I2 O75469 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30

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
SCHEMBL31467618 0.85 TRPV4 (0.39) TRPV4RORCBRS3NR1I2CYP2D6
SCHEMBL31467620 0.83 TRPV4 (0.41) TRPV4RORCCYP2D6
SCHEMBL31467604 0.82 TRPV4 (0.40) TRPV4RORCBRS3NR1I2CYP2D6
SCHEMBL25371906 0.81 TRPV4 (0.44) TRPV4PDE5AKDM4EBRS3NR1I2
SCHEMBL30567044 0.81 TRPV4 (0.44) TRPV4PDE5AKDM4EBRS3NR1I2
SCHEMBL31467598 0.81 TRPV4 (0.41) TRPV4RORCBRS3CYP2D6
SCHEMBL31467597 0.80 TRPV4 (0.40) TRPV4RORCKDM4EBRS3NR1I2
SCHEMBL31467629 0.80 TRPV4 (0.40) TRPV4RORCKDM4EBRS3NR1I2
SCHEMBL31467641 0.80 TRPV4 (0.41) TRPV4RORCBRS3CYP2D6
SCHEMBL31467643 0.80 CYP3A4 (0.47) TRPV4KDM4ECYP2D6

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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