SCHEMBL8327248

SCHEMBL8327248

CCCCCC1C(C(=O)O)=C(C)NC(c2ccccc2)=C1C(=O)OCC

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 12/20 0.68
TRPV1 Q8NER1 3/20 0.66
ALDH1A1 P00352 3/20 0.56
TMIGD3 P0DMS9 2/20 0.55
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CACNA1D Q01668 1/20 0.47

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
SCHEMBL8327558 0.88 ADORA3 (0.54) ADORA3TRPV1ALDH1A1TMIGD3LMNA
SCHEMBL8325950 0.81 ADORA3 (0.46) ADORA3TRPV1ALDH1A1TMIGD3LMNA
SCHEMBL7680777 0.81 ADORA3 (1.00) ADORA3TRPV1ALDH1A1TMIGD3CACNA1D
SCHEMBL8324841 0.81 ADORA3 (0.46) ADORA3TRPV1ALDH1A1TMIGD3LMNA
SCHEMBL29173860 0.80 ALDH1A1 (0.71) ADORA3TRPV1ALDH1A1LMNATP53
SCHEMBL7682982 0.80 ADORA3 (1.00) ADORA3TRPV1ALDH1A1TMIGD3LMNA
SCHEMBL8328228 0.79 ADORA3 (0.44) ADORA3TRPV1ALDH1A1TMIGD3LMNA
SCHEMBL7687629 0.79 ADORA3 (0.75) ADORA3TRPV1ALDH1A1TMIGD3LMNA
SCHEMBL7152871 0.78 ALDH1A1 (0.78) ADORA3ALDH1A1LMNATP53HPGD
SCHEMBL8330375 0.77 ADORA3 (0.42) ADORA3TRPV1

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-0943615-A1 1,4-DIHYDROPYRIDINE DERIVATIVES Nikken Chemicals Company, Limited (JP) 1999-09-22 EP disclosed