SCHEMBL2069006

SCHEMBL2069006

CCCCCCCCC=CCCCCCCC(C(N)=O)(C(C)CCO)C(C)CCO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.49
SOAT1 P35610 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
TP53 P04637 1/20 0.49
CYP3A4 P08684 1/20 0.49
KDM4E B2RXH2 2/20 0.45
CNR1 P21554 2/20 0.43
CNR2 P34972 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
TERT O14746 3/20 0.41
MAPT P10636 2/20 0.41
BLM P54132 2/20 0.41
HSD17B10 Q99714 2/20 0.41
FABP4 P15090 2/20 0.41
PTPN1 P18031 2/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41

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
SCHEMBL2800331 0.82 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL5313151 0.82 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL28064279 0.80 ACE2 (0.44) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL9755523 0.79 FAAH (0.47) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL7228907 0.79 FAAH (0.44) FAAHSOAT1CYP1A2CYP2C19KMT2A
Hydrochloric Acid SCHEMBL4381321 0.78 FAAH (0.46) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL28068445 0.76 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL164527 0.76 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL588276 0.76 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL1614759 0.76 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A

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-7862868-B2 Ink-jet recording material FERRANIA TECHNOLOGIES, S.P.A. (IT) 2011-01-04 US claimed