SCHEMBL9024132

SCHEMBL9024132

COc1cccc2c1c(=O)c1c(Br)ccc3c(CBr)nn2c31

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.33
▸ GAA P10253 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAOA P21397 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ KCNA3 P22001 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ KDM5A P29375 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ HASPIN Q8TF76 1/20 0.31
▸ DYRK2 Q92630 1/20 0.31
▸ MAPT P10636 2/20 0.31

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
SCHEMBL9023606 0.92 ALDH1A1 (0.34) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL9023557 0.86 MEN1 (0.34) MEN1KMT2A
SCHEMBL8543080 0.85 MAPT (0.35) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL9025537 0.84 TOP2A (0.36) HASPINDYRK2MTNR1AMTNR1B
SCHEMBL9023982 0.83 MAPT (0.36) HTTMAPT
SCHEMBL9023686 0.82 HTT (0.34) ALDH1A1KDM4EHPGDHTTMAPT
SCHEMBL9024240 0.81 KDM1A (0.38) MAOAABCG2KCNA3PARP1MEN1
SCHEMBL8545884 0.80 CYP19A1 (0.31) —
SCHEMBL9023936 0.80 NQO2 (0.34) ALDH1A1GLAHTTMAPTPARP1
SCHEMBL9023281 0.77 KMT2A (0.36) ALDH1A1GAAKDM4EGLAHPGD

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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