SCHEMBL25837944

SCHEMBL25837944

Cc1c(F)cc(S)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.33
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL29306263 0.84 TRPV4 (0.33) TRPV4HDAC1HDAC6
SCHEMBL29030086 0.79 TRPV4 (0.33) TRPV4
SCHEMBL29199453 0.79 TRPV4 (0.33) TRPV4
SCHEMBL172019 0.75 CA1 (0.35) HDAC1HDAC6
SCHEMBL5126094 0.75 TRPV4 (0.37) TRPV4
SCHEMBL48449 0.75 TRPV4 (0.37) TRPV4
SCHEMBL13991460 0.74 HDAC1 (0.31) HDAC1HDAC6
SCHEMBL19876048 0.74 HDAC1 (0.31) HDAC1HDAC6
SCHEMBL11415512 0.74 HDAC1 (0.37) HDAC1HDAC6
SCHEMBL5391101 0.72 ACHE (0.33) HDAC1HDAC6

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-2023118576-A1 DHODH INHIBITORS CONTAINING A CARBOXYLIC ACID BIOISOSTERE IMMUNIC AG (DE) 2023-06-29 WO disclosed