SCHEMBL11266229

SCHEMBL11266229

CCCCCCCCCCCCN1CCCN=CC(C)C1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.46
ALOX5 P09917 2/20 0.35
PLA2G2A P14555 1/20 0.35
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
MGLL Q99685 2/20 0.35
FAAH O00519 1/20 0.35
ALDH1A1 P00352 2/20 0.34
CNR2 P34972 3/20 0.34
CNR1 P21554 1/20 0.34
BACE1 P56817 1/20 0.33
BACE2 Q9Y5Z0 1/20 0.33
CYP19A1 P11511 2/20 0.33
OPRM1 P35372 1/20 0.32

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
SCHEMBL11266226 1.00 GBA1 (0.46) GBA1ALOX5PLA2G2APTGS1PTGS2
SCHEMBL11252860 0.92 GBA1 (0.48) GBA1ALOX5PLA2G2APTGS1PTGS2
SCHEMBL11253058 0.87 GBA1 (0.35) GBA1ALDH1A1
SCHEMBL11260580 0.84 DGKA (0.41) GBA1ALDH1A1
SCHEMBL11251175 0.79 GBA1 (0.36) GBA1ALDH1A1OPRM1
SCHEMBL11266281 0.74 DGKA (0.43) GBA1ALDH1A1
SCHEMBL11258203 0.74 ALDH1A1 (0.39) GBA1ALOX5PLA2G2APTGS1PTGS2
SCHEMBL11258187 0.74 ALDH1A1 (0.39) GBA1ALOX5PLA2G2APTGS1PTGS2
SCHEMBL9715604 0.72 GBA1 (0.42) GBA1ALOX5PTGS1PTGS2MGLL
SCHEMBL28354948 0.72 GBA1 (0.44) GBA1ALOX5ALDH1A1OPRM1

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
US-4346087-A CORROSION RESISTANCE TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-24 US disclosed