SCHEMBL9747138

SCHEMBL9747138

CC1(C)CCC(C)(C)c2cc(CCCCOCc3ccc4cc(CO)ccc4c3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP26A1 O43174 2/20 0.39
CYP26B1 Q9NR63 2/20 0.39
PPARG P37231 4/20 0.39
RARA P10276 8/20 0.38
RARB P10826 8/20 0.38
RARG P13631 8/20 0.38
RXRA P19793 2/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
GBA1 P04062 2/20 0.36
UGCG Q16739 2/20 0.36
GBA2 Q9HCG7 2/20 0.36
PLA2G4A P47712 1/20 0.35

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
SCHEMBL9746653 0.87 RARB (0.57) CYP26A1CYP26B1RARARARBRARG
SCHEMBL2095481 0.76 RXRA (0.57) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL9507898 0.74 PPARG (0.50) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL10834477 0.74 RARB (0.59) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL4668411 0.74 CYP26B1 (0.52) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL7142134 0.71 CYP26B1 (0.49) CYP26A1CYP26B1RARARARBRARG
SCHEMBL17117601 0.71 RXRA (0.48) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL9746771 0.70 RARA (0.51) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL4365965 0.70 CYP26B1 (0.55) CYP26A1CYP26B1PPARGRARARARB
SCHEMBL9746456 0.70 RARA (0.63) CYP26A1CYP26B1PPARGRARARARB

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
EP-0220118-B1 BICYCLIC NAPHTHALENIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND VETERINARY MEDICINE AND COSMETICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1992-01-02 EP claimed
US-4826969-A SKIN AND EYE DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1989-05-02 US disclosed