SCHEMBL4352272

SCHEMBL4352272

O=C1N[C@H]2[C@H](CS[C@H]2CCCCC(=O)OCc2ccccc2)N1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.65
▸ MEN1 O00255 1/20 0.63
▸ ABL1 P00519 1/20 0.63
▸ LMNA P02545 1/20 0.63
▸ PKM P14618 1/20 0.63
▸ IDE P14735 1/20 0.63
▸ MAPK1 P28482 1/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ RIN1 Q13671 1/20 0.63
▸ L3MBTL1 Q9Y468 1/20 0.63
▸ CA12 O43570 8/20 0.57
▸ CA1 P00915 8/20 0.57
▸ CA2 P00918 8/20 0.57
▸ CA9 Q16790 8/20 0.57
▸ HPSE Q9Y251 1/20 0.56
▸ HLCS P50747 4/20 0.53

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
SCHEMBL21488913 1.00 TDP1 (0.65) TDP1MEN1ABL1LMNAPKM
SCHEMBL13585655 1.00 TDP1 (0.65) TDP1MEN1ABL1LMNAPKM
SCHEMBL21488912 1.00 TDP1 (0.65) TDP1MEN1ABL1LMNAPKM
SCHEMBL27996441 1.00 TDP1 (0.65) TDP1MEN1ABL1LMNAPKM
SCHEMBL28161084 0.99 TDP1 (0.64) TDP1MEN1ABL1LMNAPKM
SCHEMBL23124066 0.84 TDP1 (0.74) TDP1MEN1ABL1LMNAPKM
SCHEMBL29556007 0.84 TDP1 (0.74) TDP1MEN1ABL1LMNAPKM
SCHEMBL7157942 0.84 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL4829292 0.83 TDP1 (0.53) TDP1MEN1ABL1LMNAPKM
Biotin SCHEMBL446893 0.83 TDP1 (0.79) TDP1MEN1ABL1LMNAPKM

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105198901-B The improved method that a kind of de- benzyl synthesizes d biotins 浙江医药股份有限公司新昌制药厂 2017-08-15 — — CN claimed
CN-104710437-B Improved method for preparing d-biotin from bisbenzyl biotin by debenzylation 富阳科兴生物化工有限公司 2017-01-25 — — CN claimed
JP-55104286-A — — None — — JP disclosed
CN-121873095-A Single benzyl biotin product, preparation method and application of single benzyl biotin 江西天新药业股份有限公司 2026-04-17 — — CN disclosed
CN-121873095-A Single benzyl biotin product, preparation method and application of single benzyl biotin 江西天新药业股份有限公司 2026-04-17 — — CN disclosed
CN-117800985-A Preparation method of 1'N-benzyl biotin 浙江圣达生物药业股份有限公司 2024-04-02 — — CN disclosed
CN-114790211-B Biotin and preparation method thereof 浙江花园营养科技有限公司 2023-11-17 — — CN disclosed
CN-114790211-A Biotin and preparation method thereof 浙江花园营养科技有限公司 2022-07-26 — — CN disclosed
CN-112390815-B Preparation method for preparing d-biotin by removing N-benzyl from Lewis acid 浙江医药股份有限公司新昌制药厂 2022-07-26 — — CN disclosed
WO-2022088291-A1 GROUP TRANSFER METHOD FOR SELECTIVE MODIFICATION OF TARGET PROTEIN AND USE THEREOF 北京大学深圳研究生院 2022-05-05 — — WO disclosed
CN-112390815-A Preparation method for preparing d-biotin by removing N-benzyl group with Lewis acid 浙江医药股份有限公司新昌制药厂 2021-02-23 — — CN disclosed
CN-101215291-B Synthesis method of (+)-biotin and its derivatives UNIV FUDAN 2010-12-29 — — CN disclosed
US-7635571-B2 photosenstizer generates singlet oxygen which oxidatively cleaves the linker to form a product which can be detected in a sandwich detection assay; kits SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2009-12-22 — — US disclosed
CN-101215292-A Synthesis method of dibenzylbiotin and its derivatives UNIV FUDAN (CN) 2008-07-09 — — CN disclosed
CN-101215291-A Synthesis method of (+)-biotin and its derivatives UNIV FUDAN (CN) 2008-07-09 — — CN disclosed
US-20040175696-A1 Amplified luminescent homogeneous immunoassay SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2004-09-09 — — US disclosed
US-6555528-B2 Protease inhibitor BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2003-04-29 — — US disclosed
US-20010016343-A1 Derivatized biotin compounds and methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2001-08-23 — — US disclosed
US-6242610-B1 REACTING PHENYLMETHYL 5-(6,8-DIAZA-6-(2-X-ACETYL)-7-OXO-3-THIABICYCLO(3.3.0)OCT-2-YL)PENTANOATE WITH HIV PROTEASE TO REDUCE THE ACTIVITY OF THE PROTEASE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2001-06-05 — — US disclosed
JP-S55104286-A PREPARATION OF THIENOIMIDAZOLINE COMPOUND SUMITOMO CHEM CO LTD 1980-08-09 — — JP disclosed
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