SCHEMBL222490

SCHEMBL222490

C1=CNC=CN=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
Hydrochloric Acid SCHEMBL6632772 0.97
Hydrochloric Acid SCHEMBL5197777 0.97
SCHEMBL27789289 0.97
Hydrochloric Acid SCHEMBL8465762 0.97
Benzene SCHEMBL29136255 0.94
Hydrazine SCHEMBL8839038 0.94
Hydrochloric Acid SCHEMBL29406158 0.94
SCHEMBL25329671 0.85
SCHEMBL31675928 0.84
SCHEMBL31675861 0.84

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 1622 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025224085-A1 COMPOUNDS CAPABLE OF ACTING ON S1R AS WELL AS ON SEH AND USES THEREOF UNIVERSITAT DE BARCELONA (ES) 2025-10-30 WO claimed
WO-2025076059-A1 ROCAGLATE DERIVATIVES AND USES THEREOF TRUSTEES OF BOSTON UNIVERSITY (US) 2025-04-10 WO claimed
US-12252492-B2 Substituted fused pyrrolo-diazepinones and uses thereof NORTHWESTERN UNIVERSITY (US) 2025-03-18 US claimed
CN-115650936-B Preparation method of (tert-butyl (3) -1, 4-diazapine-1-propyl) carbamate 天津药明康德新药开发有限公司 2024-11-01 CN claimed
WO-2023142618-A1 SYNTHESIS METHOD FOR EUPHORBIA DITERPENOID PEPLUANOL A 浙江大学杭州国际科创中心 2023-08-03 WO claimed
CN-115942938-A Medicine for preventing or treating irritable bowel syndrome or inflammatory bowel disease 比萨大学 2023-04-07 CN claimed
WO-2023036995-A1 ALKYNYLCARBINOLS WITH HIGH CYTOTOXICITY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-03-16 WO claimed
WO-2023030453-A1 COMPOUND FOR DEGRADATION OF BCL-2 FAMILY PROTEINS AND MEDICAL APPLICATION THEREOF 四川海思科制药有限公司 2023-03-09 WO claimed
EP-4126229-A1 MTORC1 MODULATORS AND USES THEREOF Aeovian Pharmaceuticals, Inc. (US) 2023-02-08 EP claimed
CN-115650936-A Preparation method of (tert-butyl (3) -1,4-diazepine-1-propyl) carbamate 天津药明康德新药开发有限公司 2023-01-31 CN claimed
EP-1369420-A1 Inhibitors of the GPib - vWF interaction Aventis Pharma Deutschland GmbH (DE) 2003-12-10 EP claimed
US-20030199689-A1 New indole derivatives as factor Xa inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-10-23 US claimed
US-20030176439-A1 Urea derivatives with antiproteolytic activity AVENTIS PHARMA DUTSCHLAND GMBH 2003-09-18 US claimed
US-6599903-B2 E.g., (S)-N-(4-(4-((3,4-dihydro-6-hydroxy-2,5,7,8-tetramethyl-2H-1-benzopyran-2 -yl)-carbonyl)-1-piperazinyl)phenyl)-2-thiophenecarboximidamide , or a salt thereof. SOCIETE DE CONSEILS DE RECHERCHES D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2003-07-29 US claimed
WO-2003044014-A1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-05-30 WO claimed
EP-1314733-A1 Indole-2-carboxamides as factor Xa inhibitors Aventis Pharma Deutschland GmbH (DE) 2003-05-28 EP claimed
US-20020198195-A1 New oxybenzamide derivatives useful for inhibiting factor Xa or VIIa SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-12-26 US claimed
WO-1996029316-A1 NEW SULFONE ESTER ANALOGUES OF iso-CLOZAPINE AND RELATED STRUCTURES: ATYPICAL NEUROLEPTICS WIKSTROEM HAAKAN (NL) 1996-09-26 WO claimed
EP-0240899-B1 1,4-DIAZEPINE BOEHRINGER INGELHEIM KG (DE) 1992-08-19 EP claimed
EP-0446133-A1 4H-Pyrrolo[1,2-a]thieno[3,2-f][1,4]diazepine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1991-09-11 EP claimed