SCHEMBL8633015

SCHEMBL8633015

CCOC(=O)CC1=CCC(C)(C)c2ccc(/C=C/OC(=O)c3ccccc3)cc21

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARA P10276 11/20 0.48
RARB P10826 10/20 0.48
RARG P13631 10/20 0.48
RXRA P19793 1/20 0.48
NR2E1 Q9Y466 1/20 0.48
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HPGD P15428 2/20 0.33
PTGS2 P35354 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSP90AA1 P07900 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL8560773 1.00 RARA (0.48) RARARARBRARGRXRANR2E1
Methane SCHEMBL8560238 0.86 RARA (0.47) RARARARBRARGRXRANR2E1
SCHEMBL6297415 0.83 RARA (0.64) RARARARBRARGRXRANR2E1
SCHEMBL6297414 0.83 RARA (0.64) RARARARBRARGRXRANR2E1
SCHEMBL8557679 0.81 RAB9A (0.37) RARARARBRARGRXRANR2E1
SCHEMBL8560240 0.81 RARA (0.46) RARARARBRARGRXRANR2E1
SCHEMBL7051352 0.81 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL8331911 0.81 RARB (0.63) RARARARBRARGRXRANR2E1
SCHEMBL8557715 0.78 RARA (0.48) RARARARBRARGRXRANR2E1
SCHEMBL6705630 0.78 RARA (0.48) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773594-A TREATING SKIN DISORDERS, REDUCING SIDE EFFECTS OF OTHER RETINOIDS ALLERGAN (US) 1998-06-30 US disclosed
US-5763635-A Tetrahydronaphthalene derivatives substituted in the 8 position with alkyhidene groups having retinoid and/or retinoid antagonist-like biological activity ALLERGAN (US) 1998-06-09 US disclosed
US-5747542-A SKIN DISORDERS; ANTICANCER AGENTS ALLERGAN (US) 1998-05-05 US disclosed
US-5741896-A O- or S- substituted tetrahydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity ALLERGAN (US) 1998-04-21 US disclosed
US-5723666-A USEFUL AS REGULATORS OF CELL PROLIFERATION AND DIFFERENTIATION ALLERGAN (US) 1998-03-03 US disclosed