SCHEMBL9569209

SCHEMBL9569209

COc1c(N2CC(=O)C(C)(C)C2)ccc2c(=O)c(C(=O)O)c[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ CSNK2A2 P19784 3/20 0.44
▸ CSNK2B P67870 3/20 0.44
▸ CSNK2A1 P68400 3/20 0.44
▸ CYP1A2 P05177 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TET2 Q6N021 1/20 0.39
▸ TET1 Q8NFU7 1/20 0.39
▸ DNA2 P51530 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ CTDSP1 Q9GZU7 1/20 0.36
▸ KCNH2 Q12809 2/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ CNR2 P34972 1/20 0.34

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
SCHEMBL9569233 0.88 HPGD (0.43) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL9569226 0.87 KDM4E (0.43) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL9569237 0.81 HPGD (0.50) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL9569241 0.78 HPGD (0.45) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL9569200 0.77 HPGD (0.46) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL9569232 0.72 KDM4E (0.39) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL7745148 0.68 KDM4E (0.41) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL16011743 0.66 KDM4E (0.42) HPGDALDH1A1KDM4ECYP1A2HSD17B10
SCHEMBL7745145 0.66 ALDH1A1 (0.41) HPGDALDH1A1KDM4ECSNK2A2CSNK2B
SCHEMBL7509122 0.64 KDM4E (1.00) HPGDALDH1A1KDM4ECSNK2A2CSNK2B

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
EP-0541086-A1 Antibacterial 6-fluoro-quinolones having an oxime group on the substituent in position 7 Kaken Pharmaceutical Co., Ltd. (JP) 1993-05-12 — — EP disclosed
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