SCHEMBL9850207

SCHEMBL9850207

COC(=O)c1ccc(OC(=O)c2ccc3c(c2)C(C)(C)CC(C)(C)O3)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.47
RARG P13631 3/20 0.47
RARA P10276 4/20 0.45
CYP3A4 P08684 3/20 0.45
KMT2A Q03164 4/20 0.43
POLB P06746 1/20 0.43
ACR P10323 2/20 0.42
HGFAC Q04756 2/20 0.42
CYP26A1 O43174 2/20 0.42
HIF1A Q16665 1/20 0.42
PRSS1 P07477 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL9850145 0.89 SSTR5 (0.46) RARBRARGRARACYP3A4CYP26A1
SCHEMBL8458446 0.87 RARA (0.57) RARBRARGRARACYP3A4KMT2A
SCHEMBL9850151 0.85 MAPT (0.48) RARBRARAKMT2APOLBACR
SCHEMBL9850236 0.85 RARB (0.45) RARBRARGRARACYP3A4KMT2A
SCHEMBL5736766 0.84 CYP26B1 (0.48) RARBRARACYP26A1HIF1APRSS1
SCHEMBL9850206 0.83 HIF1A (0.49) RARBRARAKMT2AHIF1ALMNA
SCHEMBL9850154 0.81 RARB (0.67) RARBRARGRARACYP3A4KMT2A
SCHEMBL5736859 0.80 SSTR5 (0.38) RARBRARAKMT2AHGFACCYP26A1
SCHEMBL9850280 0.80 RXRA (0.41) RARBRARGRARACYP3A4KMT2A
SCHEMBL8759232 0.80 RARB (0.47) RARBRARGRARACYP3A4CYP26A1

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