SCHEMBL28422719

SCHEMBL28422719

[CH2]CCCCCCNC(=O)CCC

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.74
NAAA Q02083 1/20 0.58
FAAH O00519 3/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
DNM1 Q05193 1/20 0.47
EPHX1 P07099 4/20 0.47
EPHX2 P34913 3/20 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
SCHEMBL1556878 1.00 CASP2 (0.74) CASP2NAAAFAAHMEN1KMT2A
SCHEMBL1556009 0.98 CASP2 (0.70) CASP2NAAAFAAHMEN1KMT2A
SCHEMBL1556215 0.92 CASP2 (0.67) CASP2NAAAFAAHMEN1KMT2A
SCHEMBL28422794 0.90 CASP2 (0.66) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL14199967 0.89 CASP2 (0.91) CASP2NAAAFAAHMEN1KMT2A
SCHEMBL10443771 0.89 CASP2 (0.69) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL5535283 0.89 CASP2 (0.69) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL10895513 0.89 CASP2 (0.69) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL5541786 0.89 CASP2 (0.69) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL7286083 0.89 CASP2 (0.69) CASP2NAAAFAAHDNM1EPHX1

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
CN-111278896-A Thermosetting resin composition and method for producing same 堺化学工业株式会社 2020-06-12 CN disclosed