SCHEMBL26065772

SCHEMBL26065772

Cc1nc(C(F)(F)F)ccc1S(=O)(=O)N1CCN(CC2(C)CCCO2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ BRS3 P32247 3/20 0.33
▸ CXCR3 P49682 2/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ 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
SCHEMBL25372391 0.89 TRPV4 (0.40) TRPV4KDM4ECYP3A4BRS3
SCHEMBL25372388 0.89 TRPV4 (0.40) TRPV4KDM4ECYP3A4BRS3
SCHEMBL26065732 0.84 TRPV4 (0.39) TRPV4KDM4EALDH1A1CYP3A4GAA
SCHEMBL26065199 0.83 TRPV4 (0.37) TRPV4KDM4EALDH1A1CYP3A4GAA
SCHEMBL26066057 0.82 KCNH2 (0.43) TRPV4KDM4EALDH1A1CYP3A4GAA
SCHEMBL26065808 0.82 TRPV4 (0.40) TRPV4KDM4EALDH1A1CYP3A4GAA
SCHEMBL26065205 0.81 SMN1; SMN2 (0.43) TRPV4KDM4EALDH1A1CYP3A4GAA
SCHEMBL26065180 0.80 TRPV4 (0.38) TRPV4KDM4EALDH1A1CYP3A4GAA
SCHEMBL26065773 0.80 KDM4E (0.37) TRPV4KDM4EALDH1A1GAAPOLB
SCHEMBL26065980 0.79 POLB (0.54) TRPV4KDM4EALDH1A1CYP3A4GAA

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-2023164063-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-08-31 — — WO disclosed
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