SCHEMBL9754512

SCHEMBL9754512

O=C(CCCCCO)NCCCO

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.55
DNM1 Q05193 1/20 0.53
FAAH O00519 3/20 0.52
CNR1 P21554 3/20 0.50
CASP2 P42575 1/20 0.48
GPR84 Q9NQS5 1/20 0.48
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
SELP P16109 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 1/20 0.46
TRPV1 Q8NER1 1/20 0.46

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
SCHEMBL14984043 0.98 NAAA (0.57) NAAADNM1FAAHCNR1CASP2
SCHEMBL14984045 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL13402876 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL6884285 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL15006988 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL25447807 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL15006922 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL29833826 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL7713571 0.95 NAAA (0.61) NAAADNM1FAAHCNR1CASP2
SCHEMBL6940499 0.95 NAAA (0.54) NAAADNM1FAAHCNR1CASP2

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-1991014376-A1 METHOD AND COMPOSITION FOR INHIBITING FAT BLOOM IN FAT BASED COMPOSITIONS AND HARD BUTTER NABISCO, INC. (US) 1991-10-03 WO disclosed