SCHEMBL10517310

SCHEMBL10517310

NCCNCCc1nn2c3cccc(O)c3c(=O)c3c(NCCN)ccc1c32

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NQO2 P16083 14/20 0.37
▸ NQO1 P15559 9/20 0.37
▸ IDO1 P14902 2/20 0.34
▸ MITF O75030 1/20 0.33
▸ TOP2A P11388 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMARCA2 P51531 1/20 0.30
▸ KEAP1 Q14145 1/20 0.30
▸ NFE2L2 Q16236 1/20 0.30

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
SCHEMBL10519205 0.94 NQO2 (0.38) NQO2NQO1IDO1MITFTOP2A
SCHEMBL9024437 0.91 NQO2 (0.37) NQO2NQO1IDO1MITFMAPT
SCHEMBL9023814 0.90 NQO2 (0.36) NQO2NQO1IDO1MITFTOP2A
SCHEMBL9024018 0.87 NQO2 (0.38) NQO2NQO1IDO1MITFTOP2A
SCHEMBL9024127 0.86 TOP2A (0.40) NQO2NQO1TOP2AMAPTHTT
SCHEMBL9023868 0.86 NQO2 (0.38) NQO2NQO1IDO1MITFTOP2A
SCHEMBL9036810 0.83 NQO2 (0.36) NQO2NQO1IDO1MITFSMARCA2
SCHEMBL9024632 0.82 NQO1 (0.35) NQO2NQO1TOP2A
SCHEMBL9023942 0.82 NQO1 (0.35) NQO2NQO1TOP2A
SCHEMBL9023958 0.81 TOP2A (0.42) NQO2NQO1MITFTOP2AMAPT

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-0347749-A2 Pyrazoloacridone derivatives with anti-tumoral activity KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-12-27 — — EP claimed
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