SCHEMBL8771704

SCHEMBL8771704

CC1(C)CC=C(c2ccccc2)c2cc(C=O)ccc21

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARA P10276 18/20 0.70
RARB P10826 18/20 0.70
RARG P13631 17/20 0.70
RXRA P19793 1/20 0.70
NR2E1 Q9Y466 1/20 0.70

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
SCHEMBL5329024 0.88 RARB (0.55) RARARARBRARGRXRANR2E1
SCHEMBL6755033 0.82 RARA (1.00) RARARARBRARGRXRANR2E1
SCHEMBL29613352 0.82 RARA (1.00) RARARARBRARGRXRANR2E1
SCHEMBL6755036 0.82 RARA (1.00) RARARARBRARGRXRANR2E1
SCHEMBL14075536 0.80 RARB (0.53) RARARARBRARGRXRANR2E1
SCHEMBL6261635 0.80 RARB (0.57) RARARARBRARGRXRANR2E1
SCHEMBL6453060 0.79 RXRA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL8026108 0.79 RARA (0.80) RARARARBRARGRXRANR2E1
SCHEMBL8771694 0.78 RARB (0.56) RARARARBRARGRXRANR2E1
SCHEMBL8771774 0.78 RARB (0.60) RARARARBRARGRXRANR2E1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661259-B1 Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity BRISTOL MYERS SQUIBB CO (US) 1997-10-08 EP disclosed
US-5648385-A TREATING RHEUMATOID ARTHRITIS BRISTOL-MYERS SQUIBB CO. (US) 1997-07-15 US disclosed
US-5618839-A Retinoid-like compounds BRISTOL-MYERS SQUIBB COMPANY (US) 1997-04-08 US disclosed
EP-0661259-A1 Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-05 EP disclosed