SCHEMBL1661905

SCHEMBL1661905

NCCc1ncncn1

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
SCHEMBL6118291 0.84 HRH3 (0.39)
SCHEMBL6017591 0.80 HRH1 (0.47)
SCHEMBL1704848 0.77
SCHEMBL1086870 0.74
Hydrochloric Acid SCHEMBL3888095 0.72 HRH1 (0.50)
Hydrochloric Acid SCHEMBL35210959 0.72 HRH1 (0.50)
SCHEMBL4736812 0.72
SCHEMBL11079946 0.69 HSP90AA1 (0.33)
SCHEMBL4606399 0.69 APLNR (0.50)
SCHEMBL18543778 0.69 HRH4 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109650509-A A kind of oil desulfurization agent 盘锦辽河油田科技实业有限公司 2019-04-19 CN claimed
US-20120277164-A1 GADD45BETA TARGETING AGENTS IMPERIAL INNOVATIONS LIMITED (GB) 2012-11-01 US claimed
EP-2491051-A2 GADD45BETA TARGETING AGENTS Imperial Innovations Limited (GB) 2012-08-29 EP claimed
WO-2011048390-A2 GADD45BETA TARGETING AGENTS IMPERIAL INNOVATIONS LIMITED (GB) 2011-04-28 WO claimed
CN-115124813-A Resin composition 味之素株式会社 2022-09-30 CN disclosed
US-10697019-B2 Method of diagnosis and prognosis IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2020-06-30 US disclosed
CN-109650509-A A kind of oil desulfurization agent 盘锦辽河油田科技实业有限公司 2019-04-19 CN disclosed
CN-107459998-A A kind of mixed type triazine radical oil desulfurization agent 梅立维 2017-12-12 CN disclosed
US-20170240592-A1 GADD45BETA/MKK7 INHIBITOR FOR THE TREATMENT OF A RESISTANT HAEMATOLOGICAL MALIGNANCY IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2017-08-24 US disclosed
EP-3180350-A1 GADD45BETA/MKK7 INHIBITOR FOR THE TREATMENT OF A RESISTANT HAEMATOLOGICAL MALIGNANCY Imperial Innovations Ltd (GB) 2017-06-21 EP disclosed
EP-3178836-A1 GADD45BETA TARGETING AGENTS Imperial Innovations Limited (GB) 2017-06-14 EP disclosed
EP-2702167-B1 METHODS OF DIAGNOSIS AND PROGNOSIS OF MULTIPLE MYELOMA, BY MEASURING GADD45BETA EXPRESSION IMP INNOVATIONS LTD (GB) 2016-12-28 EP disclosed
WO-1986003221-A1 POLYMERIC COMPOSITIONS, OIL COMPOSITIONS CONTAINING SAID POLYMERIC COMPOSITIONS, TRANSMISSION FLUIDS AND HYDRAULIC FLUIDS THE LUBRIZOL CORPORATION (US) 1986-06-05 WO disclosed
EP-0002286-B1 LUBRICANT OR FUEL ROHM AND HAAS COMPANY (US) 1984-07-04 EP disclosed
US-4411804-A CONTAINING GRAPHITE, MOLYBDENUM DISULFIDE, OR ZINC OXIDE AND FLOW CONTROL AGENT ATLANTIC RICHFIELD COMPANY (US) 1983-10-25 US disclosed
US-4292185-A COMPRISING A DIENE-MODIFIED MONOOLEFINIC POLYMER REACTED WITH CHLOROSULFONYL ISOCYANATE AND THEN WITH AN AMINE ROHM AND HAAS COMPANY (US) 1981-09-29 US disclosed
US-4160739-A Polyolefinic copolymer additives for lubricants and fuels ROHM AND HAAS COMPANY (US) 1979-07-10 US disclosed
EP-0002286-A2 Lubricant or fuel ROHM AND HAAS COMPANY (US) 1979-06-13 EP disclosed
US-4136040-A ALSO INCLUDING A NITROGEN CONTAINING MIXED ESTER OF AN OLEFIN ALPHA, B-UNSATURATED ACID OR ANHYDRIDE COPOLYMER ATLANTIC RICHFIELD COMPANY (US) 1979-01-23 US disclosed
US-3933761-A INTERPOLYMERS THE LUBRIZOL CORPORATION (US) 1976-01-20 US disclosed