SCHEMBL10657516

SCHEMBL10657516

CCCCCCC/C=C/CCCCCCCCC(=O)OCC(CC)CCCC

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.77
CYP3A4 P08684 1/20 0.77
TSHR P16473 1/20 0.77
ATM Q13315 1/20 0.77
DGKA P23743 1/20 0.64
PRKCE Q02156 1/20 0.61
PRKCQ Q04759 1/20 0.61
PRKCD Q05655 1/20 0.61
PRKCA P17252 1/20 0.61
LPAR1 Q92633 7/20 0.57
LPAR3 Q9UBY5 4/20 0.57
ENPP2 Q13822 4/20 0.57
LPAR4 Q99677 3/20 0.57
LPAR2 Q9HBW0 3/20 0.57
LPAR5 Q9H1C0 2/20 0.57
CES2 O00748 1/20 0.57
LPAR6 P43657 1/20 0.57
TRPV1 Q8NER1 1/20 0.57
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55

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
SCHEMBL28881165 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL27342818 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL333603 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL333602 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL10657519 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL9838605 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL9838603 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL28158197 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL3659727 1.00 TDP1 (0.77) TDP1CYP3A4TSHRATMDGKA
SCHEMBL20969320 0.99 TSHR (0.79) TDP1CYP3A4TSHRATMDGKA

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-4772522-A MAGNETIC POWDER, ELECTROCONDUCTIVE MATERIAL, BINDER AND FATTY ESTER TDK CORPORATION (JP) 1988-09-20 US disclosed