SCHEMBL113085

SCHEMBL113085

Cc1nc(Cl)cc(Cl)n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL786227 0.85 — —
SCHEMBL28417512 0.84 KMT2A (0.38) —
SCHEMBL13485361 0.81 — —
SCHEMBL4970873 0.81 — —
SCHEMBL115697 0.81 — —
SCHEMBL1671480 0.81 — —
SCHEMBL13501656 0.81 — —
SCHEMBL18971574 0.79 ALDH1A1 (0.46) —
SCHEMBL20840575 0.79 ALDH1A1 (0.50) —
Hydrochloric Acid SCHEMBL11187707 0.79 NPC1 (0.37) —

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 1276 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118702686-A Flavonoid derivative and preparation method and application thereof 九江学院 2024-09-27 — — CN claimed
CN-115197201-B Chrysin derivative containing aminopyrimidine ring as well as preparation method and application thereof 九江学院 2023-12-26 — — CN claimed
CN-115197201-A Chrysin derivative containing aminopyrimidine ring and preparation method and application thereof 九江学院 2022-10-18 — — CN claimed
CN-115050893-A Perovskite solar cell based on alkaloid additive 安徽大学 2022-09-13 — — CN claimed
CN-113024536-B 5-aminothiazole methanamide compound containing pyrimidine-piperazine ring and preparation method and application thereof 湖南师范大学 2022-05-27 — — CN claimed
CN-109796448-B Preparation process of dasatinib 山东罗欣药业集团股份有限公司 2022-05-10 — — CN claimed
CN-113767925-A Bactericidal composition containing captan and cymoxanil and preparation method thereof 毅植农业科技有限公司 2021-12-10 — — CN claimed
CN-113024536-A 5-aminothiazole methanamide compound containing pyrimidine-piperazine ring and preparation method and application thereof 湖南师范大学 2021-06-25 — — CN claimed
CN-109678853-B Preparation process of dasatinib 山东罗欣药业集团股份有限公司 2020-09-11 — — CN claimed
CN-109503568-B Preparation method of dasatinib 山东罗欣药业集团股份有限公司 2020-08-07 — — CN claimed
WO-2015049645-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF DASATINIB ALEMBIC PHARMACEUTICALS LIMITED (IN) 2015-04-09 — — WO claimed
US-20150057446-A1 PROCESS FOR PREPARING DASATINIB MONOHYDRATE SHILPA MEDICARE LTD (IN) 2015-02-26 — — US claimed
WO-2013157019-A2 PROCESS FOR PREPARING DASATINIB MONOHYDRATE SHILPA MEDICARE LTD. (IN) 2013-10-24 — — WO claimed
CN-102161660-A Preparation method of 2-(6-chloro-2-methylpyrimidinyl-4-amino)-N-(2-chloro-6-methylphenyl)-5-thiazolecarboxamide INST MATERIA MEDICA CAMS 2011-08-24 — — CN claimed
US-7932386-B2 Preparation of 2-amino-thiazole-5-carboxylic-acid derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2011-04-26 — — US claimed
EP-1919885-B1 PREPARATION OF 2-AMINO-THIAZOLE-5-CARBOXYLIC-ACID DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2010-04-28 — — EP claimed
US-20090030203-A1 PREPARATION OF 2-AMINO-THIAZOLE-5-CARBOXYLIC-ACID DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-29 — — US claimed
EP-1919885-A1 PREPARATION OF 2-AMINO-THIAZOLE-5-CARBOXYLIC-ACID DERIVATIVES Brystol-Myers Squibb Company (US) 2008-05-14 — — EP claimed
WO-2007019210-A1 PREPARATION OF 2-AMINO-THIAZOLE-5-CARBOXYLIC-ACID DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-15 — — WO claimed
US-20070037978-A1 Amidating chloro-, methyl-, methoxy, ethyl- or ethoxy-substituted aniline with 2,3-dichloroacryloyl chloride, alkanoate salt and inorganic base to form an N-phenyl-2-chloro-3,3-dimethoxypropionamide (that is also claimed), which is reacted with thiourea to form a N-phenyl-2-aminothiazol-5-ylcarboxamide BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-15 — — US claimed
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