SCHEMBL8539520

SCHEMBL8539520

COc1c(Br)cc(OC(C)=O)c2c1c(=O)c1c(Br)ccc3c(CBr)nn2c31

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ERO1A Q96HE7 1/20 0.33
▸ ABCB11 O95342 1/20 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
SCHEMBL8539652 0.88 ERO1A (0.33) ERO1AABCB11
SCHEMBL8547162 0.77 CYP19A1 (0.34) —
SCHEMBL8545252 0.76 ALDH1A1 (0.30) —
SCHEMBL8547454 0.73 SMN1; SMN2 (0.30) —
SCHEMBL9024132 0.73 ALDH1A1 (0.33) —
SCHEMBL8546612 0.71 HTR2A (0.32) —
SCHEMBL8548375 0.67 NQO2 (0.40) —
SCHEMBL8539725 0.67 NQO2 (0.33) —
SCHEMBL8543409 0.66 NQO2 (0.43) —
SCHEMBL9023606 0.65 ALDH1A1 (0.34) —

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-0487097-B1 Pyrazoloacridone derivatives KYOWA HAKKO KOGYO KK (JP) 1998-10-14 — — EP disclosed
US-5220026-A Antitumor agents KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-06-15 — — US disclosed
EP-0487097-A1 Pyrazoloacridone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-05-27 — — EP disclosed
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