SCHEMBL4461074

SCHEMBL4461074

CCC(C)c1ccc(O)c(C(CC)c2cc(C(C)CC)ccc2O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.61
ALDH1A1 P00352 4/20 0.61
ALOX15 P16050 2/20 0.61
HSD17B10 Q99714 2/20 0.61
USP2 O75604 1/20 0.61
PKM P14618 1/20 0.61
HPGD P15428 1/20 0.61
TSHR P16473 3/20 0.50
RORC P51449 1/20 0.50
HDAC4 P56524 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
BCHE P06276 2/20 0.43
TYR P14679 2/20 0.43
ACHE P22303 2/20 0.43
LMNA P02545 4/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
MAPK1 P28482 2/20 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
SCHEMBL487428 0.90 GAA (0.67) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL4389791 0.87 RORC (0.56) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL3152462 0.87 GAA (0.62) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL5521901 0.85 GAA (0.61) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL7890335 0.83 GAA (0.54) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL9336626 0.82 TSHR (0.72) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL4386541 0.81 RORC (0.58) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL29663703 0.81 GAA (0.59) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL5388682 0.81 RORC (0.58) GAAALDH1A1ALOX15HSD17B10USP2
SCHEMBL14154101 0.81 GAA (0.59) GAAALDH1A1ALOX15HSD17B10USP2

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-7629056-B2 SUPERIOR LOW-TEMPERATURE RAPID CURABILITY AND ALSO HAVING A LONG POT LIFE HITACHI CHEMICAL COMPANY, LTD. (JP) 2009-12-08 US disclosed
WO-2007021070-A1 FILM FOR ANISOTROPIC CONDUCTIVITY AND ELECTRONIC CIRCUITS AND DEVICES USING THE FILM CHEIL INDUSTRIES INC. (KR) 2007-02-22 WO disclosed