SCHEMBL9634897

SCHEMBL9634897

C=COCCOC(=O)CCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.48
ALDH1A1 P00352 4/20 0.43
TSHR P16473 4/20 0.42
HPGD P15428 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA1A P35348 1/20 0.38
DNM1 Q05193 1/20 0.37
MAPT P10636 2/20 0.36
BLM P54132 1/20 0.36
HTR2C P28335 1/20 0.36
MGLL Q99685 1/20 0.36
NAAA Q02083 1/20 0.35
THRB P10828 1/20 0.35
CNR1 P21554 1/20 0.35
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33

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
SCHEMBL7781762 0.89 DGKA (0.60) DGKAALDH1A1TSHRHPGDDNM1
SCHEMBL9353529 0.89 DGKA (0.46) DGKAALDH1A1TSHRHPGDADRA2A
SCHEMBL4276260 0.87 ADRA2A (0.43) DGKAALDH1A1TSHRHPGDADRA2A
SCHEMBL23581488 0.87 DGKA (0.69) DGKAALDH1A1TSHRHPGDDNM1
SCHEMBL13291406 0.86 DGKA (0.42) DGKAALDH1A1TSHRADRA2AADRA1A
SCHEMBL11920460 0.86 ACHE (0.47) DGKA
SCHEMBL15845171 0.83 DGKA (0.52) DGKAALDH1A1TSHRADRA2AADRA1A
SCHEMBL4867840 0.83 NAAA (0.47) DGKAALDH1A1TSHRHPGDADRA2A
SCHEMBL15845104 0.83 DGKA (0.47) DGKAALDH1A1TSHRADRA2AADRA1A
Ethylene Glycol Dibutanoate SCHEMBL104207 0.82 DGKA (0.65) DGKAALDH1A1TSHRADRA2AADRA1A

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-5102966-A Addition polymerization of unsaturated ethers using an unsaturated alkenyl polyether adduct as initiator and a cation-donating compound SEKISUI CHEMICAL CO., LTD. (JP) 1992-04-07 US disclosed