SCHEMBL2829086

SCHEMBL2829086

CCCCCCCCc1cc(C2CCC(c3ccc(OCC4CO4)cc3)CC2)ccc1OCC1CO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 4/20 0.40
PPARG P37231 7/20 0.40
ALDH1A1 P00352 4/20 0.40
TP53 P04637 3/20 0.40
TSHR P16473 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
HIF1A Q16665 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.40
TDP1 Q9NUW8 2/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
CYP3A4 P08684 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PKM P14618 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
SPHK2 Q9NRA0 1/20 0.36

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
SCHEMBL2830461 1.00 SPHK1 (0.40) SPHK1PPARGALDH1A1TP53TSHR
SCHEMBL2720452 1.00 SPHK1 (0.40) SPHK1PPARGALDH1A1TP53TSHR
SCHEMBL2718341 0.99 PPARG (0.40) SPHK1PPARGALDH1A1TP53TSHR
SCHEMBL2719170 0.96 PPARG (0.41) SPHK1PPARGALDH1A1TP53TSHR
SCHEMBL2717530 0.91 PPARG (0.43) PPARGALDH1A1TP53TSHRMAPT
SCHEMBL2825848 0.87 ALDH1A1 (0.38) PPARGALDH1A1TP53TSHRMAPT
SCHEMBL2832559 0.87 ALDH1A1 (0.38) PPARGALDH1A1TP53TSHRMAPT
SCHEMBL2828982 0.87 ALDH1A1 (0.38) PPARGALDH1A1TP53TSHRMAPT
SCHEMBL2718474 0.87 ALDH1A1 (0.40) PPARGALDH1A1TP53TSHRMAPT
SCHEMBL2825705 0.87 ALDH1A1 (0.40) PPARGALDH1A1TP53TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
US-20100144926-A1 EPOXY RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-10 US disclosed
EP-2133379-A1 EPOXY RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed