SCHEMBL9024950

SCHEMBL9024950

O=C(Nc1ccc2c(CBr)nn3c4ccccc4c(=O)c1c23)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ NQO2 P16083 9/20 0.38
▸ NQO1 P15559 6/20 0.38
▸ NPY5R Q15761 4/20 0.37
▸ TP53 P04637 2/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KLK7 P49862 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ S1PR3 Q99500 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
SCHEMBL9023664 0.84 KDM4E (0.45) ARKDM4ELMNANQO2NQO1
SCHEMBL9023550 0.78 G6PD (0.46) KDM4ELMNANQO2NQO1MAPT
SCHEMBL9023936 0.77 NQO2 (0.34) NQO2NQO1MAPTHTTPARP1
SCHEMBL9024240 0.73 KDM1A (0.38) NQO2NQO1PARP1
SCHEMBL9025088 0.72 ALDH1A1 (0.40) KDM4ENQO2NQO1PARP1
SCHEMBL9025257 0.70 KDM4E (0.40) KDM4ELMNANQO2NQO1MAPT
SCHEMBL9024703 0.67 NQO2 (0.48) NQO2NQO1
SCHEMBL9024559 0.66 MAPT (0.39) LMNAMAPTHTT
SCHEMBL9024920 0.66 NQO2 (0.47) NQO2NQO1MAPT
SCHEMBL9024106 0.66 NQO2 (0.47) NQO2NQO1

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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