SCHEMBL7675084

SCHEMBL7675084

CCCOCc1c(C(=O)O)ccc2c1S(=S=O)CCC2(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.34
RXRB P28702 4/20 0.34
RXRG P48443 4/20 0.34
RARG P13631 4/20 0.31
HNF4A P41235 1/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
PPARG P37231 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
SCHEMBL7678266 0.90 ALDH1A1 (0.39)
SCHEMBL7676412 0.82
SCHEMBL7622103 0.77 RXRA (0.35) RXRARXRBRXRGRARGHNF4A
SCHEMBL7621926 0.76 RXRA (0.36) RXRARXRBRXRGRARGRARA
SCHEMBL7675081 0.73 RXRA (0.35) RXRARXRBRXRGRARGHNF4A
SCHEMBL7670823 0.73 CYP3A4 (0.34) PPARG
SCHEMBL7675069 0.69 CYP3A4 (0.34) RXRARXRBRXRGPPARG
SCHEMBL27697924 0.66 ALDH1A1 (0.46)
SCHEMBL7617943 0.63 HPD (0.31)
SCHEMBL7807455 0.60 RXRA (0.32) RXRARXRBRXRG

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
US-6352959-B1 HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-03-05 US disclosed