SCHEMBL6014250

SCHEMBL6014250

CCOC(=O)c1cc2cc3c(cc2nc1N(C(N)=O)c1ccc(CC(N)=O)cc1)OCO3

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 8/20 0.39
HPGD P15428 6/20 0.39
NPSR1 Q6W5P4 3/20 0.39
ALOX15 P16050 3/20 0.39
TSHR P16473 2/20 0.39
PPP1CA P62136 2/20 0.39
USP2 O75604 2/20 0.39
HSD17B10 Q99714 5/20 0.38
MAPT P10636 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
KDM4E B2RXH2 5/20 0.37
POLB P06746 2/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 4/20 0.37

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
SCHEMBL6014277 0.94 LMNA (0.42) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014256 0.93 LMNA (0.43) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014281 0.90 LMNA (0.42) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014231 0.89 LMNA (0.42) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014312 0.89 TSHR (0.44) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014228 0.89 LMNA (0.42) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014239 0.89 LMNA (0.43) LMNATDP1ALDH1A1HPGDTSHR
SCHEMBL6016093 0.88 ALDH1A1 (0.45) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014282 0.87 RAB9A (0.41) LMNATDP1ALDH1A1HPGDNPSR1
SCHEMBL6014264 0.86 LMNA (0.40) LMNATDP1ALDH1A1HPGDNPSR1

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 2 patents. 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
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