SCHEMBL29948756

SCHEMBL29948756

CC(C)(C)[Si](C)(C)OCC1(COS(C)(=O)=O)CN(S(=O)(=O)c2ccc(Cl)cc2Cl)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 14/20 0.40
TRPM8 Q7Z2W7 2/20 0.40
KCNH2 Q12809 1/20 0.40
HSD11B1 P28845 2/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 1/20 0.35
KDM2B Q8NHM5 1/20 0.35

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
SCHEMBL23390435 1.00 TRPV4 (0.40) TRPV4TRPM8KCNH2HSD11B1KDM4E
SCHEMBL29948936 0.88 TRPV4 (0.43) TRPV4TRPM8KCNH2
SCHEMBL23390390 0.88 TRPV4 (0.43) TRPV4TRPM8KCNH2
SCHEMBL28865063 0.86 TRPV4 (0.42) TRPV4TRPM8KCNH2HSD11B1KDM4E
SCHEMBL29948981 0.83 TRPV4 (0.54) TRPV4TRPM8KCNH2
SCHEMBL23390342 0.83 TRPV4 (0.54) TRPV4TRPM8KCNH2
SCHEMBL28865060 0.80 TRPV4 (0.40) TRPV4TRPM8KCNH2HSD11B1KDM4E
SCHEMBL23424682 0.77 MAPT (0.47) TRPV4TRPM8KCNH2ALDH1A1POLB
SCHEMBL29948746 0.77 MAPT (0.47) TRPV4TRPM8KCNH2ALDH1A1POLB
SCHEMBL23390433 0.76 TRPV4 (0.55) TRPV4TRPM8KCNH2

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
EP-4061124-A1 TRPV4 RECEPTOR LIGANDS University of Utah Research Foundation (US) 2022-09-28 EP disclosed