SCHEMBL7877006

SCHEMBL7877006

CC1(C)CCC(C)(C)c2cc(-c3ccccc3-c3ccc(-c4ccc(CO)cc4)cc3)ccc21

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARB P10826 13/20 0.64
RARG P13631 12/20 0.64
RXRA P19793 5/20 0.64
RARA P10276 13/20 0.53
PDK2 Q15119 1/20 0.47
RXRB P28702 2/20 0.46
RXRG P48443 2/20 0.46
CYP26A1 O43174 2/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
CYP26B1 Q9NR63 1/20 0.41

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
SCHEMBL5845401 0.91 RARB (0.57) RARBRARGRXRARARAPDK2
SCHEMBL7794229 0.84 RARB (0.75) RARBRARGRXRARARARXRB
SCHEMBL7565094 0.84 RARB (0.62) RARBRARGRXRARARAPDK2
SCHEMBL2095481 0.79 RXRA (0.57) RARBRARGRXRARARARXRB
SCHEMBL7793710 0.78 RARB (0.62) RARBRARGRXRARARA
SCHEMBL9190381 0.78 RARA (0.53) RARBRARGRXRARARARXRB
SCHEMBL10834477 0.78 RARB (0.59) RARBRARGRXRARARARXRB
SCHEMBL6730349 0.77 RARB (0.61) RARBRARGRXRARARAPDK2
SCHEMBL10549628 0.77 RARG (0.57) RARBRARGRXRARARARXRB
SCHEMBL7794231 0.76 RARB (0.64) RARBRARGRXRARARARXRB

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-6316009-B1 FOR THERAPY OF DERMATOLOGICAL COMPLAINTS ASSOCIATED WITH A KERATINIZATION DISORDER, AND FOR COMBATING AGEING OF THE SKIN GALDERMA RESEARCH & DEVELOPMENT (FR) 2001-11-13 US disclosed