SCHEMBL8748606

SCHEMBL8748606

CC(C)(C)OC(=O)NC(C(=O)Nc1ccc(C(=O)O)s1)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 12/20 0.40
RARG P13631 12/20 0.40
RXRA P19793 10/20 0.40
RARA P10276 10/20 0.40
RXRB P28702 8/20 0.40
RXRG P48443 6/20 0.40
CYP26A1 O43174 4/20 0.39
CYP3A4 P08684 4/20 0.39
CYP26B1 Q9NR63 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
PGR P06401 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
SCHEMBL8108628 0.94 RARB (0.36) RARBRARGRXRARARARXRB
SCHEMBL8748829 0.82 RARB (0.55) RARBRARGRXRARARARXRB
SCHEMBL8748608 0.80 RXRA (0.46) RARBRARGRXRARARARXRB
SCHEMBL8106743 0.79 MEN1 (0.42) RARBRARGRXRARARARXRB
SCHEMBL8093109 0.79 RARG (0.43) RARBRARGRXRARARARXRB
SCHEMBL8757257 0.79 RARB (0.40) RARBRARGRXRARARARXRB
SCHEMBL8100983 0.78 RARB (0.44) RARBRARGRXRARARARXRB
SCHEMBL8102431 0.77 RARB (0.43) RARBRARGRXRARARARXRB
SCHEMBL8106311 0.77 RARB (0.37) RARBRARGRXRARARARXRB
SCHEMBL8093042 0.76 RORC (0.45) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661260-B1 New bi-aromatic compounds derived from amides pharmaceutical compositions and cosmetic compositions containing them and their use CIRD GALDERMA (FR) 1997-03-12 EP disclosed
EP-0661260-A1 New bi-aromatic compounds derived from amides pharmaceutical compositions and cosmetic compositions containing them and their use CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-07-05 EP disclosed