SCHEMBL456591

SCHEMBL456591

N=C(N)NN=C(N)N

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
SCHEMBL28433119 0.77 HIF1A (0.37)
SCHEMBL1770184 0.75 PLK4 (0.35)
SCHEMBL2957382 0.75
SCHEMBL5077256 0.73
Hydrochloric Acid SCHEMBL9577861 0.73
SCHEMBL581996 0.73
SCHEMBL20819089 0.71
SCHEMBL18725187 0.69
SCHEMBL18725139 0.69
SCHEMBL1770152 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1219841-A DNA-binding indole derivatives, their prodrugs and immunoconjugates as anticancer agents PANORAMA RES INC (US) 1999-06-16 CN claimed
EP-0025321-B1 COMPOSITION CONTAINING S-SULFONATED IMMUNOGLOBULIN AND AGGREGATION PREVENTING OR AGGREGATE DISSOCIATING AGENT THEREFOR, AND PROCESSES FOR PREPARING COMPOSITIONS CONTAINING HIGH PROPORTIONS OF MONOMERIC S-SULFONATED IMMUNOGLOBULIN TEIJIN LIMITED (JP) 1984-03-21 EP claimed
CN-115612071-B Preparation method of antibacterial colored polylactic acid 山东理工大学 2023-08-01 CN disclosed
CN-106518845-B Kynurenin -3- monooxygenase inhibitor, pharmaceutical composition and its application method CHDI基金会股份有限公司 2019-09-13 CN disclosed
CN-106916104-B For treating the drug of colitis 牡丹江医学院 2019-08-27 CN disclosed
US-10273231-B2 Azoline compounds substituted by a condensed ring system BASF SE (DE) 2019-04-30 US disclosed
US-20190040050-A1 AZOLINE COMPOUNDS SUBSTITUTED BY A CONDENSED RING SYSTEM BASF SE (DE) 2019-02-07 US disclosed
CN-109260925-A Environment-friendly type deodorant composition and deodorant and its application 深圳市爱康泉水处理服务有限公司 2019-01-25 CN disclosed
US-10093662-B2 Azoline compounds substituted by a condensed ring system BASF SE (DE) 2018-10-09 US disclosed
US-10085448-B2 Azoline compounds substituted by a carbocyclic condensed ring system BASF SE (DE) 2018-10-02 US disclosed
US-10023563-B2 Cyclic compounds substituted by a condensed ring system BASF SE (DE) 2018-07-17 US disclosed
CN-101103109-A Method for separating and purifying nucleic acid FUJIFILM CORP (JP) 2008-01-09 CN disclosed
CN-101010421-A Surface active agent SANYO CHEMICAL IND LTD (JP) 2007-08-01 CN disclosed
EP-1791567-A2 CHEMICALLY MODIFIED OLIGONUCLEOTIDES Alnylam Pharmaceuticals Inc. (US) 2007-06-06 EP disclosed
CN-1249086-C Melanocortin receptor ligands PROCTER & GAMBLE (US) 2006-04-05 CN disclosed
WO-2006020768-A2 CHEMICALLY MODIFIED OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2006-02-23 WO disclosed
CN-1345335-A Melanocortin receptor ligands PROCTER & GAMBLE (US) 2002-04-17 CN disclosed
CN-1280827-A Sigma receptor action medicine containing alkaloid CHENGDU INST BIOLOGY CAS (CN) 2001-01-24 CN disclosed
CN-1280825-A Sigma-receptor acting medicine containing protopine-type alkaloid CHENGDU INST BIOLOGY CAS (CN) 2001-01-24 CN disclosed
CN-1102643-A Substituted derivatives of diaminophthalimide CIBA GEIGY AG (CH) 1995-05-17 CN disclosed