SCHEMBL6014284

SCHEMBL6014284

CCOC(=O)c1cc2cc3c(cc2nc1N(C(N)=O)C1CCCCCC1)OCO3

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 4/20 0.40
NPC1 O15118 3/20 0.40
HSD17B10 Q99714 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
HPGD P15428 5/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
RAB9A P51151 2/20 0.37
CSNK1D P48730 1/20 0.37
KMT2A Q03164 3/20 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
SCHEMBL6014291 1.00 LMNA (0.42) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014315 0.99 LMNA (0.43) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014276 0.95 LMNA (0.44) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014232 0.89 KDM4E (0.41) TDP1ALDH1A1KDM4ENPC1HSD17B10
SCHEMBL6014285 0.85 TRPM8 (0.39) ALDH1A1KDM4ENPC1SMN1; SMN2TSHR
SCHEMBL6014265 0.83 LMNA (0.47) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014271 0.82 LMNA (0.47) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014316 0.80 LMNA (0.45) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014300 0.80 LMNA (0.45) LMNATDP1ALDH1A1KDM4ENPC1
SCHEMBL6014320 0.78 LMNA (0.44) LMNATDP1ALDH1A1KDM4ENPC1

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-2006128268-A1 UREIDIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND THEIR USE ON THE TREATMENT OF INFLAMMATORY DISEASES UNIVERSIDADE FEDERAL DO RIO DE JANEIRO - UFRJ (BR) 2006-12-07 WO claimed