SCHEMBL10495290

SCHEMBL10495290

CCCCCCCCCCCC=CCC(C)(C)C(C)(C)N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 6/20 0.48
TRPV1 Q8NER1 1/20 0.48
GGPS1 O95749 1/20 0.47
SOAT1 P35610 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
KDM4E B2RXH2 2/20 0.43
TERT O14746 3/20 0.42
MAPT P10636 2/20 0.42
BLM P54132 2/20 0.42
HSD17B10 Q99714 2/20 0.42
FABP4 P15090 2/20 0.42
PTPN1 P18031 2/20 0.42
PPARG P37231 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42

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
SCHEMBL1138510 0.85 FAAH (0.50) FAAHTRPV1GGPS1SOAT1CYP1A2
Hydrochloric Acid SCHEMBL6895373 0.83 FAAH (0.48) FAAHTRPV1GGPS1SOAT1CYP1A2
SCHEMBL9211674 0.83 GGPS1 (0.50) FAAHTRPV1GGPS1SOAT1CYP1A2
SCHEMBL21962008 0.80 FAAH (0.54) FAAHTRPV1GGPS1SOAT1CYP1A2
SCHEMBL21054942 0.80 FAAH (0.54) FAAHTRPV1GGPS1SOAT1CYP1A2
SCHEMBL22360921 0.78 FAAH (0.50) FAAHTRPV1SOAT1CYP1A2CYP2C19
SCHEMBL23291808 0.76 FAAH (0.74) FAAHTRPV1SOAT1CYP1A2CYP2C19
SCHEMBL25362976 0.76 FAAH (0.74) FAAHTRPV1SOAT1CYP1A2CYP2C19
SCHEMBL23040321 0.76 FAAH (0.74) FAAHTRPV1SOAT1CYP1A2CYP2C19
SCHEMBL21698564 0.76 FAAH (0.74) FAAHTRPV1SOAT1CYP1A2CYP2C19

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-4871874-A Process for producing dienes ETHYL CORPORATION (US) 1989-10-03 US disclosed