SCHEMBL9548566

SCHEMBL9548566

CCCCCCNC(=O)CC(=O)NCCCCCC

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.75
EPHX1 P07099 7/20 0.70
NAAA Q02083 1/20 0.69
FAAH O00519 3/20 0.62
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
ZDHHC20 Q5W0Z9 1/20 0.57
ZDHHC2 Q9UIJ5 1/20 0.57

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
SCHEMBL11923736 1.00 CASP2 (0.75) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL14890990 1.00 CASP2 (0.75) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL14370358 1.00 CASP2 (0.75) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL4068490 0.97 CASP2 (0.71) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL13925083 0.95 CASP2 (0.68) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL28492153 0.91 CASP2 (0.69) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL10631439 0.90 CASP2 (0.60) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL5696707 0.89 CASP2 (0.67) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL6655155 0.89 CASP2 (0.67) CASP2EPHX1NAAAFAAHMEN1
SCHEMBL2942503 0.89 CASP2 (0.67) CASP2EPHX1NAAAFAAHMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0309619-B1 RADIATION SENSITIVE ACRYLATE COMPOSITION Polychrome Corporation (US) 1993-01-27 EP claimed
US-4782005-A N,N'-diorgano dicarboxamides as oxygen inhibitors in radiation sensitive acrylate compositions POLYCHROME CORP. (US) 1988-11-01 US disclosed