SCHEMBL2829787

SCHEMBL2829787

CCc1cc(C(C)(C)c2cc(CC)c(OCCC3CO3)c(CC)c2)cc(CC)c1OCCC1CO1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 2/20 0.41
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PPARG P37231 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL2832742 0.93 MEN1 (0.40) MEN1KMT2ATP53MAPTHPGD
SCHEMBL2829816 0.92 ALDH1A1 (0.39) MEN1KMT2ATP53MAPTHPGD
SCHEMBL2832966 0.85 ALDH1A1 (0.54) MEN1KMT2ATP53MAPTHPGD
SCHEMBL2829945 0.85 ALDH1A1 (0.44) MEN1KMT2ATP53MAPTHPGD
SCHEMBL2830266 0.84 MEN1 (0.33) MEN1KMT2ATP53TSHRALDH1A1
SCHEMBL2835150 0.84 ALDH1A1 (0.45) MEN1KMT2ATP53MAPTHPGD
SCHEMBL2829958 0.82 MEN1 (0.35) MEN1KMT2ATP53TSHRALDH1A1
SCHEMBL2831170 0.82 MEN1 (0.38) MEN1KMT2ATP53TSHRALDH1A1
SCHEMBL12670352 0.81 MAPT (0.42) MEN1KMT2ATP53MAPTHPGD
SCHEMBL1904272 0.81 ALDH1A1 (0.47) MEN1KMT2ATP53MAPTHPGD

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