SCHEMBL2833567

SCHEMBL2833567

CCC(C)(C)c1cc(C(C)(C)c2cc(C(C)(C)CC)c(OCCOCC3CO3)c(C(C)(C)CC)c2)cc(C(C)(C)CC)c1OCCOCC1CO1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.43
ALDH1A1 P00352 5/20 0.43
TP53 P04637 3/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HIF1A Q16665 2/20 0.43
PPARG P37231 2/20 0.43
CYP1A2 P05177 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 1/20 0.37
MAPK1 P28482 1/20 0.36
CYP3A4 P08684 1/20 0.31
RARG P13631 1/20 0.31
RXRA P19793 1/20 0.31
GLA P06280 1/20 0.30

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
SCHEMBL2831808 0.90 SMN1; SMN2 (0.41) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2834208 0.89 TSHR (0.42) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2831264 0.88 ALDH1A1 (0.46) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2829236 0.88 ALDH1A1 (0.51) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2833773 0.87 SMN1; SMN2 (0.39) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2833484 0.87 SMN1; SMN2 (0.39) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2834967 0.85 MAPT (0.39) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2836562 0.84 MAPT (0.38) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2836746 0.84 ALDH1A1 (0.49) TSHRALDH1A1TP53MAPTHPGD
SCHEMBL2833407 0.83 MAPT (0.38) TSHRALDH1A1TP53MAPTHPGD

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