SCHEMBL56380

SCHEMBL56380

CC[CH]CC(C)CC

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
SCHEMBL27495899 1.00
SCHEMBL4655169 0.87 TSHR (0.33)
SCHEMBL306582 0.79
SCHEMBL56365 0.77
SCHEMBL10974789 0.77 ALDH1A1 (0.30)
SCHEMBL2761586 0.77
SCHEMBL10510285 0.77
SCHEMBL3362240 0.77
SCHEMBL56670 0.77
SCHEMBL306017 0.75 TSHR (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957674-A Organic silicon polyol and preparation method thereof 烟台大学 2022-08-30 CN claimed
CN-112029083-B Polyether carbonate polyol and preparation method thereof 烟台大学 2022-06-24 CN claimed
CN-112029083-A Polyether carbonate polyol and preparation method thereof 烟台大学 2020-12-04 CN claimed
EP-3474813-A1 METHOD FOR OBTAINING A CUSTOM COSMETIC TREATMENT Dermagenomic S.r.l. (IT) 2019-05-01 EP claimed
EP-3262143-A1 USE OF A LUBRICATING COMPOSITION Shell Internationale Research Maatschappij B.V. (NL) 2018-01-03 EP claimed
WO-2017221161-A1 METHOD FOR OBTAINING A CUSTOM COSMETIC TREATMENT DERMAGENOMIC S.R.L. (IT) 2017-12-28 WO claimed
CN-107188899-A 4,8 disubstituted benzenes and double thiadiazole compound, derivative and synthetic methods 苏州赛乐生物科技有限公司 2017-09-22 CN claimed
CN-104334020-B To bite flies, housefly, tick, ant, flea, midge, cockroach, spider and the control of stinkbug and repellent 贝杜基昂研究股份有限公司 2017-08-15 CN claimed
WO-2016135036-A1 USE OF A LUBRICATING COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2016-09-01 WO claimed
CN-105505406-A Preparation method of blue-phase liquid crystal composite material containing bending molecule with branched chain structure UNIV BEIJING SCIENCE & TECH 2016-04-20 CN claimed
US-5512410-A Heat image separation with phenolic thermal solvents and dye releasing couplers EASTMAN KODAK COMPANY (US) 1996-04-30 US claimed
US-RE35145-E SULFONATE SUBSTITUTED DYES FOR LIGHTFASTNESS AND HEAT RESISTANCE ZENECA LIMITED (GB) 1996-01-09 US claimed
EP-0408192-B1 Solvent soluble dye ZENECA LTD (GB) 1994-12-28 EP claimed
EP-0282182-B1 Substituted Phthalocyanine ZENECA LTD (GB) 1994-11-09 EP claimed
EP-0408195-B1 Solvent soluble dye ZENECA LTD (GB) 1994-04-27 EP claimed
US-5171848-A Salts of black trisazo dyes with alkyl amines having good solubility in organic liquids IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-15 US claimed
EP-0408195-A2 Solvent soluble dye ZENECA LIMITED (GB) 1991-01-16 EP claimed
EP-0408192-A1 Solvent soluble dye ZENECA LIMITED (GB) 1991-01-16 EP claimed
US-4824948-A INFRARED RADIATION ABSORBERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-04-25 US claimed
EP-0282182-A2 Substituted Phthalocyanine ZENECA LIMITED (GB) 1988-09-14 EP claimed