SCHEMBL22859634

SCHEMBL22859634

Cc1cc(OCc2c(S(C)(=O)=O)ccc(C(=O)C3=C(O)C4CCC(C4)C3=O)c2Cl)n(C)n1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 4/20 0.30
KDM1A O60341 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
SCHEMBL22859698 0.89 ALDH1A1 (0.35) RORC
SCHEMBL29736590 0.83 RORC (0.32) RORC
SCHEMBL22859731 0.83 RORC (0.32) RORC
SCHEMBL28549004 0.81 RORC (0.31) RORCKDM1A
SCHEMBL22859613 0.81 GPBAR1 (0.32)
SCHEMBL29736550 0.80 TSHR (0.35) RORC
SCHEMBL22859531 0.80 TSHR (0.35) RORC
SCHEMBL23061257 0.79
SCHEMBL22859704 0.78
SCHEMBL22859640 0.78

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-2021000736-A1 SUBSTITUTED BENZOYL-PYRAZOLE COMPOUND, AND APPLICATION THEREOF IN AGRICULTURE 东莞市东阳光农药研发有限公司 2021-01-07 WO disclosed