SCHEMBL25866284

SCHEMBL25866284

CCCCCCCCCC(=O)NCCCCC1CO1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
CASP2 P42575 1/20 0.57
FAAH O00519 4/20 0.55
NAAA Q02083 1/20 0.54
DNM1 Q05193 2/20 0.53
EPHX2 P34913 3/20 0.51
SLC6A5 Q9Y345 2/20 0.50
PRCP P42785 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL16802993 0.92 TP53 (0.46) ALDH1A1CASP2FAAHNAAADNM1
SCHEMBL14356159 0.89 TP53 (0.46) ALDH1A1CASP2FAAHNAAADNM1
SCHEMBL14356158 0.87 TP53 (0.47) ALDH1A1CASP2FAAHDNM1
SCHEMBL18957513 0.83 EPHX1 (0.63) ALDH1A1EPHX2
SCHEMBL23775006 0.82 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21633848 0.82 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21234011 0.82 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL22271678 0.82 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL20542645 0.82 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL846478 0.82 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-2023126006-A1 CATIONIC LIPID CONTAINING FUNCTIONAL GROUP ON SIDE CHAIN, AND USE THEREOF 厦门赛诺邦格生物科技股份有限公司 2023-07-06 WO disclosed