SCHEMBL20598

SCHEMBL20598

C1=CC[N]C=C1

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
SCHEMBL580646 0.97
SCHEMBL10872085 0.97
SCHEMBL668009 0.67
SCHEMBL2719164 0.67
SCHEMBL76038 0.67
SCHEMBL478038 0.66
SCHEMBL2498181 0.65
SCHEMBL5695369 0.63
SCHEMBL2504645 0.62
SCHEMBL10239470 0.59

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

Appears in 7317 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029739-B2 SHP2 inhibitor and use thereof KANAPH THERAPEUTICS INC. (KR) 2024-07-09 US claimed
CN-118304429-A Water-soluble cationic biphenyl aromatic hydrocarbon compound and application thereof in biomembrane treatment 中国人民解放军军事科学院军事医学研究院 2024-07-09 CN claimed
US-20240189306-A1 SHP2 INHIBITOR AND USE THEREOF KANAPH THERAPEUTICS INC. (KR) 2024-06-13 US claimed
US-20240182446-A1 TYK2 INHIBITOR COMPOUND CONTAINING BICYCLIC RING CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-06 US claimed
WO-2024113352-A1 METHODS AND COMPOSITIONS FOR DIFFERENTIATION OF PLURIPOTENT STEM CELLS AND DERIVED HEMATOPOIETIC LINEAGE CELLS NUWACELL BIOTECHNOLOGIES CO., LTD. (CN) 2024-06-06 WO claimed
WO-2024113358-A1 METHODS AND COMPOSITIONS FOR DIFFERENTIATION OF PLURIPOTENT STEM CELLS AND DERIVED NATURAL KILLER CELLS NUWACELL BIOTECHNOLOGIES CO., LTD. (CN) 2024-06-06 WO claimed
WO-2024113354-A1 CULTURE MEDIUM, COATING MATRIX AND METHOD FOR EXPANDING MIDBRAIN DOPAMINERGIC PROGENITOR CELLS NUWACELL BIOTECHNOLOGIES CO., LTD. (CN) 2024-06-06 WO claimed
CN-118103374-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2024-05-28 CN claimed
US-11992494-B2 Cyclopentathiophene carboxamide derivatives as platelet activating factor receptor antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-05-28 US claimed
WO-2024102639-A1 N-ARYLPYRAZOLE NOD2 AGONISTS AS PROMOTERS OF IMMUNE CHECKPOINT INHIBITOR THERAPY THE SCRIPPS RESEARCH INSTITUTE (US) 2024-05-16 WO claimed
US-4507143-A REDUCE INJURY TO CROPS MONSANTO COMPANY (US) 1985-03-26 US claimed
EP-0125207-A1 2-Tetrazolylpropyl-2-penem derivatives, process for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1984-11-14 EP claimed
US-4439433-A CEPHALOSPORIN ANTIBIOTICS ROUSSEL UCLAF (FR) 1984-03-27 US claimed
EP-0022141-B1 COMPOSITIONS AND METHODS FOR REDUCING HERBICIDAL INJURY MONSANTO COMPANY (US) 1983-06-08 EP claimed
EP-0011513-B1 PROCESS FOR PREPARING BETA-LACTAM ANTIBIOTICS PLANTEX LIMITED (IL) 1982-09-22 EP claimed
US-4254029-A SILYLATION, AMIDATION WITH A PHENYLGLYCYL CHLORIDE HYDROCHLORIDE AND HYDROLYSIS TO PRODUCE PENICILLIN AND CEPHALOSPORIN DERIVATIVES PLANTEX LTD. (IL) 1981-03-03 US claimed
EP-0022141-A1 Compositions and methods for reducing herbicidal injury MONSANTO COMPANY (US) 1981-01-14 EP claimed
EP-0011513-A1 Process for preparing beta-lactam antibiotics PLANTEX LIMITED (IL) 1980-05-28 EP claimed
US-4137408-A BACTERICIDES, ANTIBIOTICS WARNER-LAMBERT (US) 1979-01-30 US claimed
US-4053470-A BACTERICIDES, ANTIBIOTICS PARKE, DAVIS & COMPANY (US) 1977-10-11 US claimed