SCHEMBL9850185

SCHEMBL9850185

CCOC(=O)c1ccc(OC(=O)c2cc3c(cc2CC)OCCC3(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARA P10276 8/20 0.56
RARB P10826 8/20 0.56
RXRA P19793 7/20 0.53
HNF4A P41235 2/20 0.53
RARG P13631 5/20 0.42
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
PRSS1 P07477 1/20 0.39
ACR P10323 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RXRG P48443 3/20 0.39
RXRB P28702 2/20 0.39

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
SCHEMBL9850221 0.93 RARA (0.54) RARARARBRXRAHNF4ARARG
SCHEMBL9850253 0.92 RXRA (0.49) RARARARBRXRAHNF4ARARG
SCHEMBL9850153 0.92 RARA (0.64) RARARARBRXRAHNF4ARARG
SCHEMBL9850261 0.91 RARB (0.53) RARARARBRXRAHNF4ARARG
SCHEMBL9850240 0.91 RARA (0.52) RARARARBRXRAHNF4ARARG
SCHEMBL9850106 0.86 RXRA (0.48) RARARARBRXRAHNF4ARARG
SCHEMBL8461526 0.85 RARA (0.62) RARARARBRXRAHNF4ARARG
SCHEMBL9850096 0.85 RARA (0.56) RARARARBRXRAHNF4ARARG
SCHEMBL9850358 0.84 RARB (0.50) RARARARBRXRAHNF4ARARG
SCHEMBL9850172 0.84 RXRA (0.46) RARARARBRXRAHNF4ARARG

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-0435681-A1 Chroman esters of phenols and benzoic acids having retinoid-like activity ALLERGAN, INC. (US) 1991-07-03 EP disclosed
US-5006550-A Skin disorder, arthritis, wound healing agents, dry eye syndrome ALLERGAN, INC. (US) 1991-04-09 US disclosed