SCHEMBL6014313

SCHEMBL6014313

CCOC(=O)c1cc2cc3c(cc2nc1N(C(N)=O)c1ccccc1OC)OCO3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.40
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HPGD P15428 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 6/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 5/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 2/20 0.37
TSHR P16473 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CTNNB1 P35222 1/20 0.37
WNT3A P56704 1/20 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
SCHEMBL6014304 0.88 ALDH1A1 (0.41) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014239 0.86 LMNA (0.43) LMNAALDH1A1SMN1; SMN2HPGDTDP1
SCHEMBL6014261 0.85 NPC1 (0.42) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014266 0.85 LMNA (0.39) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6016093 0.84 ALDH1A1 (0.45) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014312 0.83 TSHR (0.44) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014256 0.82 LMNA (0.43) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014273 0.82 LMNA (0.41) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014303 0.82 LMNA (0.41) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL6014277 0.81 LMNA (0.42) LMNAALDH1A1SMN1; SMN2HPGDNPSR1

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