SCHEMBL5556524

SCHEMBL5556524

CCCCCCCCCCC[CH]CCCCCCN=C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.47
TSHR P16473 2/20 0.41
FAAH O00519 3/20 0.38
TRPV1 Q8NER1 1/20 0.38
TRPA1 O75762 1/20 0.34
EP300 Q09472 1/20 0.34
TERT O14746 3/20 0.33
MAPT P10636 2/20 0.33
BLM P54132 2/20 0.33
HSD17B10 Q99714 2/20 0.33
FABP4 P15090 2/20 0.33
PTPN1 P18031 2/20 0.33
PPARG P37231 2/20 0.33
PPARD Q03181 2/20 0.33
PPARA Q07869 2/20 0.33
GMNN O75496 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL2564975 1.00 NAAA (0.47) NAAATSHRFAAHTRPV1TRPA1
SCHEMBL9539470 0.92 TSHR (0.41) NAAATSHRFAAHTRPV1EP300
SCHEMBL7032782 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL37878 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL1066415 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL7029381 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL22578571 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL7032914 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL7034321 0.88 FAAH (0.52) NAAAFAAHTRPV1TERTMAPT
SCHEMBL15486455 0.87 NAAA (0.58) NAAATSHRHSD17B10FABP4PTPN1

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
WO-2007060434-A1 EMULSIONS CRODA INTERNATIONAL PLC (GB) 2007-05-31 WO disclosed