SCHEMBL9856310

SCHEMBL9856310

Cc1c(C=O)ccc2cc(-c3ccc4c(c3)C(C)(C)CCC4(C)C)ccc12

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARA P10276 15/20 0.50
RARB P10826 15/20 0.50
RARG P13631 14/20 0.50
RXRA P19793 4/20 0.41
CYP26A1 O43174 1/20 0.36
CYP26B1 Q9NR63 1/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
ERN1 O75460 1/20 0.34

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
SCHEMBL10834973 0.83 RARA (0.48) RARARARBRARGRXRA
SCHEMBL9856299 0.79 RARB (0.56) RARARARBRARGRXRACYP26A1
Methane SCHEMBL9856408 0.78 ESR1 (0.57) RARARARBRARGRXRACYP26A1
SCHEMBL9856398 0.78 RARB (0.62) RARARARBRARGRXRACYP26A1
SCHEMBL10834806 0.77 RARG (0.50) RARARARBRARGRXRAESR1
SCHEMBL9856405 0.76 RARA (0.52) RARARARBRARGRXRACYP26A1
SCHEMBL10834705 0.76 RARB (0.59) RARARARBRARGRXRACYP26A1
SCHEMBL9856377 0.75 RARA (0.46) RARARARBRARGRXRAESR1
SCHEMBL9856391 0.75 RARA (0.49) RARARARBRARGRXRACYP26A1
SCHEMBL10835359 0.73 RARB (0.49) RARARARBRARGRXRA

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-5041639-A Polysubstituted derivatives of naphtalene, their process of preparation and their application in the cosmetic and pharmaceutical fields CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1991-08-20 US disclosed
US-4886907-A TREATMENT OF DERMATOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1989-12-12 US disclosed