SCHEMBL9024051

SCHEMBL9024051

COc1ccc2c(CNCCNC(=O)OCc3ccccc3)nn3c4ccccc4c(=O)c1c23

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 1/20 0.41
▸ BRD4 O60885 2/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ STING1 Q86WV6 4/20 0.37
▸ IRF3 Q14653 1/20 0.36
▸ PDE1B Q01064 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ TNKS O95271 1/20 0.35
▸ TNKS2 Q9H2K2 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
SCHEMBL9024234 0.83 BRD4 (0.44) BRD4LMNASMN1; SMN2HTT
SCHEMBL9023722 0.81 TOP2A (0.38) L3MBTL1
SCHEMBL9024984 0.75 NQO2 (0.45) —
SCHEMBL9024240 0.74 KDM1A (0.38) KMT2AL3MBTL1MEN1
SCHEMBL9023946 0.74 NQO2 (0.42) —
SCHEMBL9023829 0.74 NQO2 (0.43) —
SCHEMBL9024129 0.70 ABCB1 (0.36) KMT2AL3MBTL1MEN1SMN1; SMN2GAA
SCHEMBL4366616 0.69 CD274 (0.58) CD274KMT2AMEN1LMNASMN1; SMN2
SCHEMBL9025389 0.69 KDM1A (0.41) KMT2AL3MBTL1MEN1LMNASMN1; SMN2
SCHEMBL9024667 0.69 NQO1 (0.39) CD274KMT2AMEN1LMNASMN1; SMN2

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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