SCHEMBL9023931

SCHEMBL9023931

CN(C)CCNCc1nn2c3cccc(O)c3c(=O)c3c(NCCN(C)C)ccc1c32

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NQO2 P16083 16/20 0.47
▸ NQO1 P15559 6/20 0.47
▸ MITF O75030 1/20 0.44
▸ SMARCA2 P51531 1/20 0.42
▸ KEAP1 Q14145 1/20 0.42
▸ NFE2L2 Q16236 1/20 0.42
▸ RAD52 P43351 1/20 0.35
▸ UHRF1 Q96T88 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ KDR P35968 1/20 0.35

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
SCHEMBL9024803 0.93 NQO2 (0.41) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9023796 0.93 NQO2 (0.47) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9024639 0.91 NQO2 (0.42) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9023832 0.87 NQO2 (0.46) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9032596 0.87 NQO2 (0.46) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9024826 0.87 NQO2 (0.63) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9023791 0.86 NQO2 (0.45) NQO2NQO1MITFSMARCA2KEAP1
SCHEMBL9024437 0.86 NQO2 (0.37) NQO2NQO1MITF
SCHEMBL9023958 0.85 TOP2A (0.42) NQO2NQO1MITF
SCHEMBL8547450 0.84 NQO1 (0.43) NQO2NQO1MITFSMARCA2KEAP1

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 claimed
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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