SCHEMBL6014294

SCHEMBL6014294

NC(=O)Cc1cc2cc3c(cc2nc1-c1ccccc1NC(N)=O)OCO3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 5/20 0.46
MAPT P10636 4/20 0.46
MEN1 O00255 4/20 0.46
HPGD P15428 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TSHR P16473 3/20 0.46
TP53 P04637 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
POLB P06746 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL6014298 0.70 TRPM8 (0.41) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014251 0.70 ALDH1A1 (0.43) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014272 0.70 LMNA (0.41) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014270 0.70 LMNA (0.41) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014227 0.69 MAPT (0.40) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014229 0.69 ALDH1A1 (0.41) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014234 0.69 MAPT (0.40) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014309 0.69 TSHR (0.44) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6016092 0.68 ALDH1A1 (0.45) KMT2AALDH1A1KDM4EMAPTMEN1
SCHEMBL6014275 0.68 DHODH (0.42) KMT2AALDH1A1KDM4EMAPTMEN1

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