SCHEMBL8906010

SCHEMBL8906010

CCCCCc1cc2c(cc1C=Cc1ccccc1C(=O)O)C(C)(C)CCC2(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 14/20 0.49
RARA P10276 3/20 0.41
RARB P10826 3/20 0.41
RARG P13631 3/20 0.41
RXRB P28702 3/20 0.41
RXRG P48443 3/20 0.41
TRPA1 O75762 1/20 0.38
TRPM2 O94759 1/20 0.38
PLA2G1B P04054 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
HNF4A P41235 2/20 0.37
PTPN11 Q06124 1/20 0.37
PLK1 P53350 1/20 0.37

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
SCHEMBL8905251 0.97 RXRA (0.53) RXRARARARARBRARGRXRB
SCHEMBL8905607 0.87 RXRA (0.42) RXRARXRBRXRGTRPA1TRPM2
SCHEMBL8910622 0.84 RXRA (0.43) RXRARARARARBRARGRXRB
SCHEMBL8906153 0.84 RXRA (0.45) RXRARXRBRXRG
SCHEMBL8907175 0.83 RXRA (0.42) RXRARARARARBRARGRXRB
SCHEMBL8904416 0.83 RXRA (0.52) RXRARARARARBRARGRXRB
SCHEMBL7213554 0.82 RARB (0.64) RXRARARARARBRARGRXRB
SCHEMBL7213560 0.82 RARB (0.64) RXRARARARARBRARGRXRB
SCHEMBL10842696 0.81 RARB (0.63) RXRARARARARBRARGRXRB
SCHEMBL4669367 0.81 RARB (0.63) RXRARARARARBRARGRXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5700836-A TOPICALLY ADMINISTERING TO TREAT PHOTODAMAGED SKIN HOFFMANN-LA ROCHE INC. (US) 1997-12-23 US claimed
US-5700836-A TOPICALLY ADMINISTERING TO TREAT PHOTODAMAGED SKIN HOFFMANN-LA ROCHE INC. (US) 1997-12-23 US disclosed