SCHEMBL6014287

SCHEMBL6014287

COC(=O)c1cc2cc3c(cc2nc1N(C(N)=O)c1ccc(S(C)(=O)=O)cc1)OCO3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.40
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 5/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HSD17B10 Q99714 3/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RAB9A P51151 3/20 0.36
TARBP2 Q15633 1/20 0.35

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
SCHEMBL6014242 0.87 ALDH1A1 (0.46) HPGDALDH1A1KDM4EATMLMNA
SCHEMBL6014255 0.81 HPGD (0.41) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6014256 0.79 LMNA (0.43) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6016093 0.79 ALDH1A1 (0.45) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6014281 0.78 LMNA (0.42) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6014277 0.78 LMNA (0.42) HPGDALDH1A1KDM4EATMLMNA
SCHEMBL6014282 0.78 RAB9A (0.41) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6014231 0.77 LMNA (0.42) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6014228 0.77 LMNA (0.42) HPGDALDH1A1KDM4ELMNANPSR1
SCHEMBL6014312 0.77 TSHR (0.44) HPGDALDH1A1KDM4ELMNANPSR1

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