SCHEMBL8771749

SCHEMBL8771749

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

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARB P10826 19/20 0.56
RARA P10276 19/20 0.56
RARG P13631 17/20 0.56
RXRA P19793 1/20 0.56
NR2E1 Q9Y466 1/20 0.56

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
SCHEMBL8771791 0.87 RARB (0.54) RARBRARARARGRXRANR2E1
SCHEMBL18868819 0.81 RARB (0.70) RARBRARARARGRXRANR2E1
SCHEMBL8771774 0.81 RARB (0.60) RARBRARARARGRXRANR2E1
SCHEMBL6264492 0.81 RARA (0.52) RARBRARARARGRXRANR2E1
SCHEMBL6261635 0.80 RARB (0.57) RARBRARARARGRXRANR2E1
SCHEMBL6258858 0.79 RARA (0.58) RARBRARARARGRXRANR2E1
SCHEMBL6264495 0.79 RARA (0.55) RARBRARARARGRXRANR2E1
SCHEMBL8771694 0.78 RARB (0.56) RARBRARARARGRXRANR2E1
SCHEMBL8771650 0.78 RARB (0.77) RARBRARARARGRXRANR2E1
SCHEMBL8771964 0.77 RARB (0.68) RARBRARARARGRXRANR2E1

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 5 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
CN-1144217-A Retinoid-like compounds BRISTOL MYERS SQUIBB CO (US) 1997-03-05 CN disclosed
EP-0661259-A1 Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-05 EP disclosed