SCHEMBL95613

SCHEMBL95613

CC(C)NCCCO

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 SCHEMBL1551987 0.97
SCHEMBL104210 0.92
SCHEMBL18555614 0.89 LMNA (0.39)
SCHEMBL3315871 0.89 LMNA (0.39)
SCHEMBL13532069 0.89 LMNA (0.39)
SCHEMBL25554530 0.85 LMNA (0.31)
SCHEMBL143017 0.81
SCHEMBL23075826 0.81 ADRB2 (0.42)
SCHEMBL479263 0.81 HRH4 (0.39)
SCHEMBL2600364 0.81 HRH4 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119978177-A Raw material composition of solid titanium catalyst component, catalyst, preparation method and application thereof 中国石油化工股份有限公司 2025-05-13 CN claimed
CN-107217268-B Chlorination containing 2-, the corrosion inhibiter of the poly- hydroxypropyl isopropylamine quaternary surfactant of 3- 中国民航大学 2019-05-14 CN claimed
CN-107217268-A Containing 2 chlorinations, the corrosion inhibiter of 3 poly- hydroxypropyl isopropylamine quaternary surfactants 中国民航大学 2017-09-29 CN claimed
CN-107162918-A 2 chlorinations, the synthetic method of 3 poly- hydroxypropyl isopropylamine quaternary surfactants 中国民航大学 2017-09-15 CN claimed
US-8367591-B2 Lubricating oil composition IDEMITSU KOSAN CO., LTD. (JP) 2013-02-05 US claimed
EP-1399409-B1 METHOD FOR PRODUCING (METH)ACRYLIC ACID ESTERS BASF SE (DE) 2012-10-31 EP claimed
US-7268251-B2 Method for producing (meth) acrylic acid esters BASF AKTIENGESELLSCHAFT (DE) 2007-09-11 US claimed
US-7026503-B2 Method for producing (meth)acrylic acid esters BASF AKTIENGESELLSCHAFT (DE) 2006-04-11 US claimed
EP-1399408-B1 METHOD FOR PRODUCING (METH)ACRYLIC ACID ESTERS BASF AG (DE) 2006-03-22 EP claimed
EP-1140860-B1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2004-09-22 EP claimed
US-6593326-B1 Useful as anti-cancer agents; and processes for their manufacture and pharmaceutical compositions containing them are described. Apoptotic effect in a warm-blooded animal such as man. ASTRAZENECA AB (SE) 2003-07-15 US claimed
WO-2002092577-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO claimed
WO-2002092578-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO claimed
EP-1140860-A1 PYRIMIDINE COMPOUNDS AstraZeneca AB (SE) 2001-10-10 EP claimed
WO-2000039101-A1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2000-07-06 WO claimed
JP-56055358-A None JP disclosed
WO-2026100508-A1 RESIN COMPOSITION, CURED PRODUCT, LAMINATE, METHOD FOR PRODUCING CURED PRODUCT, METHOD FOR PRODUCING LAMINATE, METHOD FOR PRODUCING SEMICONDUCTOR DEVICE, SEMICONDUCTOR DEVICE, AND RESIN 富士フイルム株式会社 2026-05-15 WO disclosed
JP-S5655358-A PREPARATION OF ISOPROPYLAMINOPROPANOL MITSUI TOATSU CHEM INC 1981-05-15 JP disclosed
US-4080471-A ANTIARRYTHMIA AKTIEBOLAGET HASSLE (SW) 1978-03-21 US disclosed
US-4080471-A ANTIARRYTHMIA AKTIEBOLAGET HASSLE (SW) 1978-03-21 US disclosed