SCHEMBL11547143

SCHEMBL11547143

O=[N+]([O-])c1oc2ccccc2c1-c1ccc(CO)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HNF4A P41235 2/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ PTPN1 P18031 5/20 0.40
▸ TNKS O95271 1/20 0.40
▸ PARP1 P09874 1/20 0.40
▸ CSNK2A2 P19784 1/20 0.40
▸ CSNK2B P67870 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ TNKS2 Q9H2K2 1/20 0.40
▸ PARP2 Q9UGN5 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ LMNA P02545 2/20 0.38
▸ HPGD P15428 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ MAPK1 P28482 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
SCHEMBL10759258 0.86 TNKS (0.40) HNF4AHSP90AA1PTPN1TNKSPARP1
SCHEMBL11470987 0.85 ABCC4 (0.46) HNF4AHSP90AA1PTPN1TNKSPARP1
SCHEMBL11497962 0.84 ALDH1A1 (0.39) HNF4AHSP90AA1PTPN1TNKSPARP1
SCHEMBL11549511 0.84 HNF4A (0.42) HNF4AHSP90AA1ALDH1A1MAPTMEN1
SCHEMBL7274704 0.84 MAPT (0.46) HNF4AHSP90AA1PTPN1TNKSPARP1
SCHEMBL10761966 0.82 MAPT (0.41) HNF4AHSP90AA1PTPN1CSNK2A2CSNK2B
SCHEMBL11552348 0.82 HNF4A (0.43) HNF4AHSP90AA1ALDH1A1MAPTLMNA
SCHEMBL11457320 0.81 LMNA (0.47) HNF4AHSP90AA1PTPN1TNKSPARP1
SCHEMBL11465464 0.81 TNKS (0.50) PTPN1TNKSPARP1CSNK2A2CSNK2B
SCHEMBL11666642 0.79 TNKS (0.51) HNF4AHSP90AA1TNKSPARP1CSNK2A2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4153716-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1979-05-08 — — US disclosed
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