SCHEMBL8726786

SCHEMBL8726786

O=C(CO)OCCOCCOCCCl

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
TSHR P16473 3/20 0.37
TP53 P04637 2/20 0.37
HIF1A Q16665 2/20 0.37
HSD17B10 Q99714 1/20 0.37
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
SERPINE1 P05121 1/20 0.31
CYP2C19 P33261 1/20 0.30
DGKA P23743 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
SCHEMBL3385884 0.88 TSHR (0.44) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL8917298 0.85
SCHEMBL8724105 0.84 ADRA2A (0.43) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL6560315 0.81 MEN1 (0.55) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL20913720 0.81 MEN1 (0.55) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL822271 0.81 MEN1 (0.55) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL10726776 0.80 CYP2C19 (0.47) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL243060 0.80 ADRA2A (0.43) ALDH1A1TSHRTP53HIF1AADRA2A
SCHEMBL8919715 0.77 ALDH1A1 (0.58) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL5344405 0.77 TSHR (0.37) ALDH1A1TSHRTP53HIF1AHSD17B10

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-5766960-A Receptor membranes AUSTRALIAN MEMBRANE AND BIOTECHNOLOGY RESEARCH INSTITUTE (AU) 1998-06-16 US disclosed