SCHEMBL9023350

SCHEMBL9023350

O=c1c2c(O)cccc2n2nc(CNCCOCCO)c3ccc(NCCNCCO)c1c32

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 2/20 0.38
▸ NQO1 P15559 2/20 0.35
▸ NQO2 P16083 2/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ USP2 O75604 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ TP53 P04637 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ RECQL P46063 2/20 0.34
▸ BLM P54132 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ CSNK2A1 P68400 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ SLC22A2 O15244 1/20 0.34
▸ SLC22A1 O15245 1/20 0.34
▸ CACNA1F O60840 1/20 0.34
▸ SLC22A3 O75751 1/20 0.34
▸ NSD2 O96028 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
SCHEMBL9023862 0.95 NQO2 (0.36) TOP2ANQO1NQO2KMT2ASMN1; SMN2
SCHEMBL9023958 0.93 TOP2A (0.42) TOP2ANQO1NQO2MEN1USP2
SCHEMBL9024021 0.93 NQO1 (0.34) TOP2ANQO1NQO2ALDH1A1
SCHEMBL9025443 0.92 NQO2 (0.37) TOP2ANQO1NQO2
SCHEMBL9023942 0.92 NQO1 (0.35) TOP2ANQO1NQO2
SCHEMBL9024639 0.90 NQO2 (0.42) NQO1NQO2PAX8
SCHEMBL9024127 0.89 TOP2A (0.40) TOP2ANQO1NQO2MEN1USP2
SCHEMBL9024803 0.87 NQO2 (0.41) TOP2ANQO1NQO2MEN1USP2
SCHEMBL9024018 0.86 NQO2 (0.38) TOP2ANQO1NQO2MEN1USP2
SCHEMBL9024967 0.85 ALDH1A1 (0.31) ALDH1A1

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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