SCHEMBL27340789

SCHEMBL27340789

O=C(O)c1cn(C2CC2)c2c(Cl)cccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.55
▸ TOP2A P11388 7/20 0.49
▸ TOP2B Q02880 7/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ CHRM2 P08172 1/20 0.47
▸ CHRM1 P11229 1/20 0.47
▸ OPRM1 P35372 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ KCNH2 Q12809 2/20 0.44
▸ GSK3B P49841 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ PIK3CG P48736 2/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL27339827 0.84 TOP2A (0.58) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL10915179 0.82 TOP2A (0.58) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL10627007 0.82 KCNH2 (0.48) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL7998227 0.81 KDM4E (0.52) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL4714374 0.81 KDM4E (0.52) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL29793501 0.81 KDM4E (0.52) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL2670640 0.79 TOP2A (0.50) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL4715010 0.79 KDM4E (0.57) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL4482132 0.79 ALDH1A1 (0.58) KDM4ETOP2ATOP2BALDH1A1POLB
SCHEMBL4714357 0.78 KDM4E (0.49) KDM4ETOP2ATOP2BALDH1A1POLB

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
CN-1044118-C 7-isoindolinyl-quinolone derivatives and process for their preparation BAYER AG (DE) 1999-07-14 — — CN disclosed
CN-1189494-A Substituted isoazalene compound BAYER AG (DE) 1998-08-05 — — CN disclosed
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