SCHEMBL6014292

SCHEMBL6014292

NC(=O)NCc1ccccc1.O=C(O)c1cc2cc3c(cc2nc1-c1ccccc1)OCO3

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.43
TP53 P04637 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CYP1A2 P05177 1/20 0.43
HIF1A Q16665 1/20 0.43
GAA P10253 3/20 0.43
DHODH Q02127 1/20 0.42
ALDH1A1 P00352 7/20 0.42
HPGD P15428 4/20 0.42
MAPT P10636 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 3/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
PKM P14618 3/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL6014233 0.89 ALDH1A1 (0.41) TP53SMN1; SMN2CYP1A2HIF1AGAA
SCHEMBL6014236 0.86 ALDH1A1 (0.44) TP53SMN1; SMN2CYP1A2HIF1AGAA
Urea SCHEMBL6014244 0.80 ALDH1A1 (0.49) TP53SMN1; SMN2CYP1A2HIF1ADHODH
SCHEMBL6014249 0.77 MAPT (0.42) TP53SMN1; SMN2CYP1A2HIF1AGAA
SCHEMBL6014259 0.72 ALDH1A1 (0.43) TP53SMN1; SMN2GAAALDH1A1HPGD
SCHEMBL6014267 0.71 ALDH1A1 (0.44) TP53SMN1; SMN2CYP1A2HIF1AGAA
SCHEMBL6014314 0.70 ALDH1A1 (0.41) TP53SMN1; SMN2CYP1A2HIF1AGAA
SCHEMBL17942776 0.70 KMT2A (0.52) TP53SMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL6014296 0.69 KMT2A (0.41) TP53SMN1; SMN2CYP1A2HIF1AGAA
SCHEMBL6014269 0.69 KMT2A (0.40) TP53SMN1; SMN2CYP1A2HIF1AGAA

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