SCHEMBL9850140

SCHEMBL9850140

CCCCCc1cc2c(cc1C(=O)Oc1ccc(C(=O)OC)cc1)C(C)(C)CC(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MGLL Q99685 1/20 0.41
RXRA P19793 3/20 0.39
RARB P10826 2/20 0.38
RARA P10276 1/20 0.38
PRSS1 P07477 1/20 0.37
ACR P10323 1/20 0.37
CYP3A4 P08684 3/20 0.37
RARG P13631 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CNR2 P34972 3/20 0.36
CNR1 P21554 2/20 0.36
POLB P06746 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL9850280 0.93 RXRA (0.41) MAPTSMN1; SMN2MGLLRXRARARB
SCHEMBL9850095 0.92 RARA (0.47) MAPTRXRARARBRARAPRSS1
SCHEMBL9850227 0.92 RXRA (0.48) RXRARARBRARATSHR
SCHEMBL9850290 0.91 MAPT (0.41) MAPTSMN1; SMN2RXRARARBRARA
SCHEMBL9850306 0.87 HIF1A (0.41) MAPTRXRARARBRARAPRSS1
SCHEMBL9850174 0.85 RARB (0.48) MAPTSMN1; SMN2MGLLRXRARARB
SCHEMBL9850216 0.85 RARA (0.49) MAPTRXRARARBRARAPRSS1
SCHEMBL9850214 0.85 RXRA (0.52) RXRARARBRARARARG
SCHEMBL9850094 0.84 MAPT (0.43) MAPTSMN1; SMN2RXRARARBRARA
SCHEMBL9850236 0.83 RARB (0.45) MAPTSMN1; SMN2RARBRARAPRSS1

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