SCHEMBL11034148

SCHEMBL11034148

[CH2]CCOCC(O)CCC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.46
USP2 O75604 1/20 0.42
HTT P42858 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
LPAR5 Q9H1C0 1/20 0.36
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
PLA2G2C Q5R387 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
SCHEMBL10513780 0.86 HSD17B10 (0.61) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL8016289 0.86 HSD17B10 (0.61) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL8016294 0.86 HSD17B10 (0.61) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL28464587 0.82 USP2 (0.55) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL4746506 0.82
SCHEMBL5907150 0.81 KDM4E (0.48) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL795575 0.80 USP2 (0.48) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL7171054 0.80 USP2 (0.59) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL28254598 0.79 USP2 (0.53) HSD17B10USP2HTTCYP1A2CYP3A4
SCHEMBL2563382 0.78 USP2 (0.52) HSD17B10USP2HTTCYP1A2CYP3A4

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-4522824-A ADRENERGIC BLOCKING AGENTS SANOFI (FR) 1985-06-11 US disclosed