SCHEMBL9636286

SCHEMBL9636286

C=COCCOc1ccc(CC(c2ccc(OCCOC=C)cc2)c2ccc(OCCOC=C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.37
PPARD Q03181 3/20 0.37
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
PPARA Q07869 2/20 0.35
FFAR1 O14842 2/20 0.35
THRB P10828 1/20 0.34
ACACB O00763 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HRH3 Q9Y5N1 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
SCHEMBL9635109 0.81 PPARG (0.36) PPARGPPARDITGB3ITGA2BPPARA
SCHEMBL26312618 0.81 HRH3 (0.40) THRBHRH3
SCHEMBL26312614 0.81 HRH3 (0.37) THRBHRH3
SCHEMBL419937 0.80 THRB (0.41) THRB
SCHEMBL1506190 0.79 LTA4H (0.47) CYP1A2CYP2D6CYP2C19HRH3
SCHEMBL21610572 0.78 KMT2A (0.47)
SCHEMBL5607785 0.76 ALDH1A1 (0.53) PPARGPPARDPPARATHRB
SCHEMBL7719874 0.76 LMNA (0.53) HRH3
SCHEMBL13888322 0.76 KEAP1 (0.51)
SCHEMBL9179345 0.76 HRH3 (0.45) PPARGPPARATHRBHRH3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5102966-A Addition polymerization of unsaturated ethers using an unsaturated alkenyl polyether adduct as initiator and a cation-donating compound SEKISUI CHEMICAL CO., LTD. (JP) 1992-04-07 US disclosed