SCHEMBL3376452

SCHEMBL3376452

CCc1c(O)ccc2nc3c(cc12)Cn1c-3cc2c(c1=O)COC(=O)[C@]2(O)CC

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 18/20 0.85
▸ MEN1 O00255 6/20 0.85
▸ KMT2A Q03164 6/20 0.85
▸ SMN1; SMN2 Q16637 5/20 0.85
▸ KDM4E B2RXH2 4/20 0.85
▸ CASP1 P29466 3/20 0.85
▸ CASP7 P55210 3/20 0.85
▸ HBB P68871 3/20 0.85
▸ MAPT P10636 3/20 0.85
▸ USP2 O75604 2/20 0.85
▸ LMNA P02545 2/20 0.85
▸ BRCA1 P38398 2/20 0.85
▸ KEAP1 Q14145 2/20 0.85
▸ NFE2L2 Q16236 2/20 0.85
▸ HIF1A Q16665 2/20 0.85
▸ CYP3A4 P08684 2/20 0.85
▸ SLC22A2 O15244 1/20 0.85
▸ TOP2A P11388 1/20 0.85
▸ TOP2B Q02880 1/20 0.85
▸ SLC47A2 Q86VL8 1/20 0.85

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
SCHEMBL27477913 1.00 TOP1 (0.85) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27781717 0.94 TOP1 (0.84) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2423989 0.94 TOP1 (0.84) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL4289849 0.93 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL3377674 0.93 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL30884751 0.93 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL23432496 0.93 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27504832 0.93 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27595325 0.93 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
Topotecan SCHEMBL5531617 0.92 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007052308-A2 GLYCO-PHOSPHORYLATED BIOLOGICALLY ACTIVE AGENTS BRAIN N' BEYOND BIOTECH PVT. LTD. (IN) 2007-05-10 — — WO claimed
CN-1159192-A Substituted camptothecin derivatives and process for their preparation PHARMACIA & UPJOHN SPA (IT) 1997-09-10 — — CN claimed
EP-0777670-A1 SUBSTITUTED CAMPTOTHECIN DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1997-06-11 — — EP claimed
WO-1996037496-A1 SUBSTITUTED CAMPTOTHECIN DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.P.A. (IT) 1996-11-28 — — WO claimed
US-11834458-B2 Anti-cancer nuclear hormone receptor-targeting compounds NUVATION BIO INC. (US) 2023-12-05 — — US disclosed
US-9457098-B2 Asymmetric bifunctional silyl monomers and particles thereof as prodrugs and delivery vehicles for pharmaceutical, chemical and biological agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-10-04 — — US disclosed
US-9457098-B2 Asymmetric bifunctional silyl monomers and particles thereof as prodrugs and delivery vehicles for pharmaceutical, chemical and biological agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-10-04 — — US disclosed
US-20150065670-A1 ASYMMETRIC BIFUNCTIONAL SILYL MONOMERS AND PARTICLES THEREOF AS PRODRUGS AND DELIVERY VEHICLES FOR PHARMACEUTICAL, CHEMICAL AND BIOLOGICAL AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-03-05 — — US disclosed
US-20150065670-A1 ASYMMETRIC BIFUNCTIONAL SILYL MONOMERS AND PARTICLES THEREOF AS PRODRUGS AND DELIVERY VEHICLES FOR PHARMACEUTICAL, CHEMICAL AND BIOLOGICAL AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-03-05 — — US disclosed
EP-1995249-B1 CAMPTOTHECIN DERIVATIVES AND THEIR USE SHANGHAI INST MATERIA MEDICA (CN) 2010-11-10 — — EP disclosed
US-20090325996-A1 CAMPTOTHECIN DERIVATIVES AND THEIR USE SHANGHAI HAIHE PHARMACEUTICAL CO., LTD. (CN) 2009-12-31 — — US disclosed
EP-1995249-A1 CAMPTOTHECIN DERIVATIVES AND THEIR USE Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2008-11-26 — — EP disclosed
US-5856333-A ANTITUMOR AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 1999-01-05 — — US disclosed
CN-1159192-A Substituted camptothecin derivatives and process for their preparation PHARMACIA & UPJOHN SPA (IT) 1997-09-10 — — CN disclosed
EP-0777670-A1 SUBSTITUTED CAMPTOTHECIN DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1997-06-11 — — EP disclosed
WO-1996037496-A1 SUBSTITUTED CAMPTOTHECIN DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.P.A. (IT) 1996-11-28 — — WO 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 (3 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 531/4885MEN1 2250/4885KMT2A 2014/4885
US-20150065670-A1 ASYMMETRIC BIFUNCTIONAL SILYL MONOMERS AND PARTICLES THEREOF AS PRODRUGS AND DELIVERY VEHICLES FOR PHARMACEUTICAL, CHEMICAL AND BIOLOGICAL AGENTS PAICS, BSG, ILK TOP1 3788/4885MEN1 1428/4885KMT2A 3412/4885
US-20090325996-A1 CAMPTOTHECIN DERIVATIVES AND THEIR USE TOP2A, TOP1, TOP2B TOP1 2/4885MEN1 599/4885KMT2A 4529/4885

“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.

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