SCHEMBL8797472

SCHEMBL8797472

CC1=C(C(=O)OCCCc2cccnc2)C(CC(C)C)C(C(=O)OCCCc2cccnc2)=C(C)N1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.47
FFAR3 O14843 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.42
HPGD P15428 2/20 0.42
CASP1 P29466 2/20 0.42
CASP7 P55210 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
FKBP1A P62942 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TBXAS1 P24557 2/20 0.41
GLA P06280 1/20 0.40

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
SCHEMBL8797283 0.88 CHRNA7 (0.42) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8797726 0.87 CHRNA7 (0.48) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8797402 0.86 CHRNA7 (0.53) CHRNA7FKBP1ATBXAS1
SCHEMBL8797176 0.86 LMNA (0.52) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8796913 0.85 CHRNA7 (0.52) CHRNA7ALDH1A1HSD17B10FKBP1ATBXAS1
SCHEMBL8797096 0.85 CHRNA7 (0.47) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8797141 0.85 L3MBTL1 (0.49) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8798057 0.85 CHRNA7 (0.40) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8797447 0.84 CHRNA7 (0.46) CHRNA7KDM4EALDH1A1GAAHPGD
SCHEMBL8797106 0.84 LMNA (0.49) CHRNA7KDM4EALDH1A1GAAHPGD

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-0801065-A1 1,4-DIHYDROPYRIDINE COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1997-10-15 EP disclosed