SCHEMBL19960974

SCHEMBL19960974

CCCCCC(=O)NCCCCCCNC(C)=O

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.71
FAAH O00519 5/20 0.68
NAAA Q02083 1/20 0.67
DNM1 Q05193 2/20 0.64
KDM4E B2RXH2 1/20 0.61
MAPK1 P28482 1/20 0.61
HIF1A Q16665 1/20 0.61
EPHX2 P34913 3/20 0.61
ADRA1A P35348 1/20 0.60
SLC6A5 Q9Y345 2/20 0.59
EPHX1 P07099 2/20 0.55

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
SCHEMBL19960886 1.00 CASP2 (0.71) CASP2FAAHNAAADNM1KDM4E
SCHEMBL19960728 0.98 CASP2 (0.69) CASP2FAAHNAAADNM1KDM4E
SCHEMBL27137140 0.94 CASP2 (0.74) CASP2FAAHNAAADNM1KDM4E
SCHEMBL19960600 0.92 FAAH (0.63) CASP2FAAHNAAADNM1EPHX2
SCHEMBL23775006 0.92 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21633848 0.92 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL11335765 0.92 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL20542645 0.92 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21234011 0.92 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL906177 0.92 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2

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-2018048928-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO disclosed