SCHEMBL8922993

SCHEMBL8922993

CCCCCCCCC=CCCCCCCCC(=O)Sc1nc2ccccc2s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.50
DAGLA Q9Y4D2 1/20 0.50
CES1 P23141 1/20 0.50
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
SOAT2 O75908 1/20 0.45
SOAT1 P35610 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALOX5 P09917 1/20 0.45
LMNA P02545 2/20 0.44
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL28158532 0.84 MAPT (0.57) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL1667887 0.83 FAAH (0.58) FAAHDAGLACES1SMN1; SMN2HPGD
SCHEMBL1667888 0.83 FAAH (0.58) FAAHDAGLACES1SMN1; SMN2HPGD
Stearic Acid SCHEMBL28326180 0.78 SMN1; SMN2 (0.60) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL10759166 0.76 L3MBTL1 (0.55) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL3098198 0.76 SMN1; SMN2 (0.68) MAPTSMN1; SMN2POLBALDH1A1HPGD
SCHEMBL1668218 0.75 DRD2 (0.62) MAPTSMN1; SMN2ALDH1A1HPGDTSHR
SCHEMBL3752137 0.75 DRD2 (0.62) MAPTSMN1; SMN2ALDH1A1HPGDTSHR
SCHEMBL8923210 0.74 SOAT2 (0.59) FAAHMAPTPOLBALDH1A1HPGD
SCHEMBL10761735 0.74 MAPT (0.56) MAPTSMN1; SMN2POLBALDH1A1HPGD

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-5646098-A Carbonyl containing compounds and their derivatives as multi-functional fuel and lube additives EXXON CHEMICAL PATENTS INC (US) 1997-07-08 US disclosed