SCHEMBL9023550

SCHEMBL9023550

O=c1c2ccccc2n2nc(CBr)c3ccc(O)c1c32

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ G6PD P11413 1/20 0.46
▸ HTT P42858 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ NQO1 P15559 5/20 0.35
▸ NQO2 P16083 5/20 0.35
▸ KDM5A P29375 1/20 0.34
▸ GLA P06280 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ RGS12 O14924 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL9024559 0.87 MAPT (0.39) G6PDHTTMAPTLMNAMEN1
SCHEMBL9023936 0.86 NQO2 (0.34) G6PDHTTMAPTNQO1NQO2
SCHEMBL9025049 0.83 G6PD (0.47) G6PDHTTMAPTNQO1NQO2
SCHEMBL9024240 0.81 KDM1A (0.38) NQO1NQO2MEN1KMT2AMAOA
SCHEMBL9025088 0.81 ALDH1A1 (0.40) NQO1NQO2GLARECQLALDH1A1
SCHEMBL9023847 0.80 G6PD (0.39) G6PDHTTMAPTNQO1NQO2
SCHEMBL9023982 0.79 MAPT (0.36) G6PDHTTMAPT
SCHEMBL9024950 0.78 AR (0.40) HTTMAPTNQO1NQO2LMNA
SCHEMBL9737128 0.76 G6PD (0.46) G6PDHTTMAPTNQO1NQO2
SCHEMBL9023606 0.69 ALDH1A1 (0.34) HTTMAPTNQO2KDM5AGLA

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 2 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
Send feedback