SCHEMBL5249763

SCHEMBL5249763

O=C1NC(=O)C(=Cc2cc3cc(Cc4ccc(-c5ccccc5)cc4)ccc3[nH]c2=O)S1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.52
HPGD P15428 2/20 0.49
PPARA Q07869 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
GLS O94925 2/20 0.46
GLS2 Q9UI32 2/20 0.46
PTP4A3 O75365 1/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TTR P02766 3/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
BLM P54132 1/20 0.43
PLA2G1B P04054 1/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
GSK3B P49841 1/20 0.43
PIM1 P11309 1/20 0.43
PIM3 Q86V86 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
SCHEMBL5245204 0.81 PTPN1 (0.52) PTPN1HPGDPPARANR1H4GLS
SCHEMBL1249955 0.79 TTR (0.58) HPGDNR1H4MEN1KMT2ATTR
SCHEMBL157197 0.79 TTR (0.58) HPGDNR1H4MEN1KMT2ATTR
SCHEMBL159267 0.76 PIM1 (0.55) PTPN1HPGDMEN1KMT2ATTR
SCHEMBL1249059 0.76 PIM1 (0.55) PTPN1HPGDMEN1KMT2ATTR
SCHEMBL1248928 0.73 GSK3B (0.64) PTPN1HPGDALDH1A1KDM4EPOLB
SCHEMBL1248930 0.73 GSK3B (0.64) PTPN1HPGDALDH1A1KDM4EPOLB
SCHEMBL12891790 0.71 PIM1 (0.83) PTPN1HPGDGLSGLS2MEN1
SCHEMBL1248780 0.71 PIM1 (0.83) PTPN1HPGDGLSGLS2MEN1
SCHEMBL1248782 0.71 PIM1 (0.83) PTPN1HPGDGLSGLS2MEN1

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
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed