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SCHEMBL8829331

SCHEMBL8829331

O=C1c2c(c3c4cccc(OCc5ccccc5)c4n([C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)c3c3[nH]c4c(OCc5ccccc5)cccc4c23)C(=O)N1COCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 19/20 0.54
▸ PRKCA P17252 9/20 0.53
▸ EGFR P00533 5/20 0.52

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
SCHEMBL8829470 0.99 TOP1 (0.56) TOP1PRKCAEGFR
SCHEMBL8769931 0.81 GALR3 (0.40) TOP1PRKCAEGFR
SCHEMBL8769342 0.81 GALR3 (0.40) TOP1PRKCAEGFR
SCHEMBL5828301 0.81 TOP1 (0.49) TOP1PRKCAEGFR
SCHEMBL8314297 0.79 NQO1 (0.47) PRKCA
SCHEMBL26843410 0.71 TOP1 (0.85) TOP1PRKCAEGFR
SCHEMBL8500119 0.71 TOP1 (1.00) TOP1PRKCAEGFR
SCHEMBL29435340 0.71 TOP1 (1.00) TOP1PRKCAEGFR
SCHEMBL8769934 0.69 TOP1 (1.00) TOP1PRKCAEGFR
SCHEMBL6623957 0.69 TOP1 (1.00) TOP1PRKCAEGFR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5668271-A Indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-09-16 — — US disclosed
US-5591842-A ANTICARCINOGENIC AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-01-07 — — US disclosed
EP-0545195-B1 Indolopyrrolocarbazole derivatives BANYU PHARMA CO LTD (JP) 1995-11-22 — — EP disclosed
EP-0545195-A1 Indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-06-09 — — EP disclosed