SCHEMBL8829280

SCHEMBL8829280

O=C1NC(=O)c2c1c1c3ccc(O)cc3[nH]c1c1c2c2ccc(O)cc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 20/20 1.00
PRKD3 O94806 8/20 0.74
PRKCG P05129 8/20 0.74
PRKCB P05771 8/20 0.74
PRKCA P17252 8/20 0.74
PRKCH P24723 8/20 0.74
PRKCI P41743 8/20 0.74
PRKCE Q02156 8/20 0.74
PRKCQ Q04759 8/20 0.74
PRKCZ Q05513 8/20 0.74
PRKCD Q05655 8/20 0.74
PRKD1 Q15139 8/20 0.74

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
SCHEMBL14422834 0.91 TOP1 (0.84) TOP1PRKD3PRKCGPRKCBPRKCA
SCHEMBL14581742 0.90 TOP1 (0.81) TOP1PRKD3PRKCGPRKCBPRKCA
SCHEMBL8500729 0.90 TOP1 (0.81) TOP1PRKD3PRKCGPRKCBPRKCA
SCHEMBL29489888 0.90 TOP1 (0.87) TOP1PRKD3PRKCGPRKCBPRKCA
SCHEMBL6739046 0.90 TOP1 (0.87) TOP1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3969257 0.88 TOP1 (1.00) TOP1PRKD3PRKCGPRKCBPRKCA
SCHEMBL14581767 0.85 TOP1 (0.76) TOP1PRKD3PRKCGPRKCBPRKCA
Edotecarin SCHEMBL14422833 0.85 TOP1 (1.00) TOP1PRKD3PRKCGPRKCBPRKCA
Edotecarin SCHEMBL29358386 0.85 TOP1 (1.00) TOP1PRKD3PRKCGPRKCBPRKCA
Edotecarin SCHEMBL29358250 0.85 TOP1 (1.00) TOP1PRKD3PRKCGPRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834458-B2 Anti-cancer nuclear hormone receptor-targeting compounds NUVATION BIO INC. (US) 2023-12-05 US disclosed
WO-2022204184-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NUVATION BIO INC. (US) 2022-09-29 WO disclosed
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
US-5589365-A ANTITUMOR BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-12-31 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11834458-B2 Anti-cancer nuclear hormone receptor-targeting compounds NCOA1, NCOR1, NCOA3 TOP1 531/4885PRKD3 1398/4885PRKCG 1953/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.