SCHEMBL6819356

SCHEMBL6819356

COc1cc(S(=O)(=O)Cl)c(Br)cc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 2/20 0.41
▸ UTS2R Q9UKP6 8/20 0.41
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ PKM P14618 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ PRKDC P78527 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL31075362 1.00 TRPV4 (0.41) TRPV4UTS2RHTR2AHTR2CPKM
SCHEMBL5835283 0.81 TRPV4 (0.50) TRPV4UTS2RPKMTSHRPRKDC
SCHEMBL31658274 0.81 TRPV4 (0.50) TRPV4UTS2RPKMTSHRPRKDC
SCHEMBL5835086 0.80 TRPV4 (0.46) TRPV4UTS2RHTR2AHTR2CPKM
SCHEMBL5745043 0.80 TRPV4 (0.49) TRPV4HTR2AHTR2CPKMTSHR
SCHEMBL29679428 0.80 TRPV4 (0.49) TRPV4HTR2AHTR2CPKMTSHR
SCHEMBL25381430 0.79 TRPV4 (0.45) TRPV4HTR2AHTR2CPKMTSHR
SCHEMBL31036241 0.77 GAA (0.51) TRPV4PKMTSHRKDM4EALDH1A1
SCHEMBL21032455 0.74 NOTUM (0.47) TRPV4NOTUM
SCHEMBL5240836 0.73 TRPV4 (0.50) TRPV4TSHRPRKDCKDM4EALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024177984-A1 BENZOTHIA(DIA)ZEPINE COMPOUNDS FOR TREATMENT OF HBV AND HDV ASSEMBLY BIOSCIENCES, INC. (US) 2024-08-29 — — WO disclosed
WO-2004043366-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 — — WO disclosed
WO-2004043366-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 — — WO disclosed
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