SCHEMBL8736175

SCHEMBL8736175

CC1(C)CCC(C)(C)c2cc(C3(c4[c]cccc4)N=NN=N3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.36
RXRB P28702 9/20 0.35
RXRG P48443 9/20 0.35
RARB P10826 7/20 0.35
RARG P13631 6/20 0.35
CYP26B1 Q9NR63 6/20 0.34
CYP26A1 O43174 5/20 0.34
RARA P10276 4/20 0.33
PPARG P37231 1/20 0.33
CYP3A4 P08684 1/20 0.32

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
SCHEMBL7756527 0.81 RXRA (0.49) RXRARXRBRXRGRARBRARG
SCHEMBL8754681 0.69 RXRA (0.46) RXRARXRBRXRGRARBRARG
SCHEMBL7762907 0.68 TP53 (0.48) RXRA
SCHEMBL7761638 0.67 RXRA (0.47) RXRARXRBRXRGRARBRARG
SCHEMBL2877333 0.66
SCHEMBL7760432 0.64 RXRA (0.69) RXRARXRBRXRGRARBRARG
SCHEMBL7756674 0.63 RXRA (0.50) RXRARXRBRXRGRARBRARG
SCHEMBL7756544 0.63 RXRA (0.59) RXRARXRBRXRGRARBRARG
SCHEMBL7761224 0.62 RXRA (0.54) RXRARXRBRXRGRARBRARG
SCHEMBL25673 0.62 SLC6A4 (0.31)

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-5849729-A Use of hydrolyzed cocoa butter for percutaneous absorption HERSHEY FOODS CORPORATION (US) 1998-12-15 US disclosed