SCHEMBL27449129

SCHEMBL27449129

CC(=O)OC(CCCC=O)OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.36
TSHR P16473 4/20 0.36
MAPT P10636 3/20 0.35
TDP1 Q9NUW8 1/20 0.34
TRPV1 Q8NER1 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
GALR3 O60755 1/20 0.31
BLM P54132 1/20 0.31
CTSK P43235 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL11543731 0.87 TSHR (0.39) TSHRMAPTTDP1TRPV1SMN1; SMN2
SCHEMBL2230506 0.82 TSHR (0.46) TSHRMAPTTDP1TRPV1SMN1; SMN2
SCHEMBL10786488 0.80 TSHR (0.43) TSHRMAPTTDP1TRPV1SMN1; SMN2
SCHEMBL6509562 0.79 F7 (0.43) MAPTUSP2ALDH1A1HPGDCHRM1
SCHEMBL6509566 0.79 F7 (0.43) MAPTUSP2ALDH1A1HPGDCHRM1
SCHEMBL10782810 0.77 TSHR (0.50) TSHRMAPTTDP1TRPV1SMN1; SMN2
SCHEMBL7177949 0.76 TSHR (0.34) HIF1ATSHRMAPTTDP1TRPV1
SCHEMBL16265050 0.76 PRKCA (0.45) TSHRTRPV1CTSK
SCHEMBL7204024 0.76 PRKCA (0.49) MAPTTDP1USP2CYP3A4CHRM1
SCHEMBL11140994 0.76 ALDH1A1 (0.44) TSHRALDH1A1

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
CN-1116267-C Process for producing branched aldehydes KURARAY CO (JP) 2003-07-30 CN disclosed
CN-1197788-A Process for producing branched aldehydes KURARAY CO (JP) 1998-11-04 CN disclosed