SCHEMBL8308701

SCHEMBL8308701

CCCCCCCCCC(=O)N(C)c1cc(N)ccc1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
GLA P06280 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
CDC25B P30305 1/20 0.36
KDM5A P29375 1/20 0.36

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
SCHEMBL6578901 0.86 GAA (0.42) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL6577096 0.83 GAA (0.44) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL3735228 0.82 KMT2A (0.49) ALDH1A1ALOX12KMT2AKDM4EHSD17B10
SCHEMBL6579987 0.81 GAA (0.49) GAAALDH1A1MAPTKMT2AKDM4E
SCHEMBL6579489 0.81 GAA (0.51) GAAALDH1A1MAPTKMT2AKDM4E
SCHEMBL6579314 0.77 ALDH1A1 (0.44) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL6582955 0.77 ALDH1A1 (0.44) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL6581936 0.76 ALDH1A1 (0.49) GAAALDH1A1MAPTNPC1RAB9A
SCHEMBL10364413 0.74 ALDH1A1 (0.39) ALDH1A1MAPTALOX12KMT2AKDM4E
SCHEMBL3735946 0.74 KMT2A (0.46) ALDH1A1ALOX12KMT2AKDM4EHSD17B10

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
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed