SCHEMBL6014247

SCHEMBL6014247

CCOC(=O)c1cc2cc3c(cc2nc1N)OCO3

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
TDP1 Q9NUW8 1/20 0.53
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 10/20 0.49
HPGD P15428 7/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
RAB9A P51151 5/20 0.49
NPC1 O15118 4/20 0.49
GAA P10253 2/20 0.49
HSD17B10 Q99714 6/20 0.48
MAPT P10636 4/20 0.48
TSHR P16473 3/20 0.48
RXFP1 Q9HBX9 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
ALOX15 P16050 2/20 0.46
PKM P14618 1/20 0.46
PRKCI P41743 1/20 0.46
PRKCZ Q05513 1/20 0.46
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45

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
SCHEMBL6862895 0.86 LMNA (0.54) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL30952911 0.82 LMNA (0.56) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL24961545 0.82 LMNA (0.56) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL6014265 0.81 LMNA (0.47) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL6014271 0.80 LMNA (0.47) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL11545648 0.79 ALDH1A1 (0.54) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL6014316 0.79 LMNA (0.45) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL6014300 0.79 LMNA (0.45) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL6014276 0.78 LMNA (0.44) LMNATDP1KDM4EALDH1A1HPGD
SCHEMBL6014281 0.78 LMNA (0.42) LMNATDP1KDM4EALDH1A1HPGD

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 disclosed