SCHEMBL4064007

SCHEMBL4064007

NCc1ccc[c]c1N

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
SCHEMBL6634272 0.79
SCHEMBL2390537 0.79
SCHEMBL156993 0.76 PNMT (0.39)
SCHEMBL4415208 0.76 DAO (0.33)
SCHEMBL1385609 0.74
SCHEMBL21571282 0.74
SCHEMBL8204656 0.74 HTR2A (0.47)
SCHEMBL5091335 0.74 GABRA1 (0.41)
SCHEMBL3684256 0.73 TLR8 (0.40)
SCHEMBL3684618 0.71 LIPG (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110087781-A Purposes of the coating on Chrome-free tinplate substrate PPG工业俄亥俄公司 2019-08-02 CN disclosed
CN-105899571-A Coating composition PPG工业俄亥俄公司 2016-08-24 CN disclosed
CN-105899570-A Coating composition PPG工业俄亥俄公司 2016-08-24 CN disclosed
CN-102884142-B Coating composition PPG COATINGS EUROPE B.V. (NL) 2016-06-01 CN disclosed
CN-103298785-B Low Temperature Synthesis of Methylphenidate Hydrochloride RHODES TECHNOLOGIES (US) 2016-04-20 CN disclosed
CN-104822677-A Fluoroalkyl-1, 4-benzodiazepine ketone compound BRISTOL MYERS SQUIBB CO 2015-08-05 CN disclosed
CN-102516869-B Binder composition SIGMA COATINGS BV 2015-07-08 CN disclosed
CN-103130731-B Method for preparing 4-amino-5-aryl-1,2,4-triazole-3-thioketone UNIV SHAANXI SCIENCE & TECH 2015-06-03 CN disclosed
CN-104583255-A Antifouling coating composition PPG COATINGS EUROP B V 2015-04-29 CN disclosed
CN-104312389-A Coating compositions containing high Mn polyesters and low Mn polyesters SUZHOU PPG PACKAGING COATING CO LTD 2015-01-28 CN disclosed
EP-0948496-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE Amgen inc. (US) 1999-10-13 EP disclosed
WO-1999032448-A1 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE AMGEN INC. (US) 1999-07-01 WO disclosed
WO-1999028303-A1 PROCESS OF PREPARING SUBSTITUTED PYRIMIDINONES AMGEN, INC. (US) 1999-06-10 WO disclosed
WO-1999024404-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC. (US) 1999-05-20 WO disclosed
CN-1196732-A Bis-amino acid hydroxyethylamino sulfonamide retroviral protease inhibitors SEARLE & CO (US) 1998-10-21 CN disclosed
CN-1186499-A Amino acid hydroxyethylamino sulfonamide retroviral protease inhibitors SEARLE & CO (US) 1998-07-01 CN disclosed
WO-1998024780-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 WO disclosed
WO-1998024782-A2 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 WO disclosed
CN-1183767-A Sulfonylalkanoylamino hydroxyethylamino sulfonamide retroviral protease inhibitors SEARLE & CO (US) 1998-06-03 CN disclosed
CN-1183102-A Heterocyclic carbonyl amino acid hydroxyethylamino sulfonamide retroviral protease inhibitors SEARLE & CO (US) 1998-05-27 CN disclosed