SCHEMBL9024054

SCHEMBL9024054

COc1cccc2c1c(=O)c1c(OC)ccc3c(CNCCN)nn2c31

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 6/20 0.38
▸ HASPIN Q8TF76 2/20 0.37
▸ DYRK2 Q92630 1/20 0.37
▸ CHRM2 P08172 1/20 0.34
▸ BRD4 O60885 1/20 0.33
▸ HEXA P06865 1/20 0.33
▸ HEXB P07686 1/20 0.33
▸ SCN8A Q9UQD0 1/20 0.32
▸ KCNA3 P22001 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9025537 0.92 TOP2A (0.36) TOP2AHASPINDYRK2CHRM2BRD4
SCHEMBL9025183 0.91 NQO2 (0.38) TOP2AHASPINDYRK2BRD4NQO2
SCHEMBL9023722 0.90 TOP2A (0.38) TOP2AHASPINDYRK2CHRM2SCN8A
SCHEMBL9025524 0.90 TOP2A (0.38) TOP2AHASPINDYRK2CHRM2BRD4
SCHEMBL9024397 0.88 TOP2A (0.40) TOP2AHASPINDYRK2CHRM2BRD4
SCHEMBL9024084 0.86 NQO2 (0.37) TOP2AHASPINDYRK2CHRM2BRD4
SCHEMBL8546736 0.83 NQO2 (0.43) TOP2ANQO2
SCHEMBL9023606 0.82 ALDH1A1 (0.34) HASPINDYRK2KCNA3ALDH1A1GAA
SCHEMBL9023686 0.81 HTT (0.34) TOP2AALDH1A1MAPTKDM4EHPGD
SCHEMBL9032596 0.80 NQO2 (0.46) NQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0347749-B1 Pyrazoloacridone derivatives with anti-tumoral activity KYOWA HAKKO KOGYO KK (JP) 1996-04-24 — — EP disclosed
US-5079358-A Humans; leukemia KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-01-07 — — US disclosed
EP-0347749-A2 Pyrazoloacridone derivatives with anti-tumoral activity KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-12-27 — — EP disclosed
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