SCHEMBL8137671

SCHEMBL8137671

C1CCC(NC2CCCCC2)CC1.CCN(CC)CC

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
HSD17B10 Q99714 1/20 0.60
KMT2A Q03164 1/20 0.46
THRB P10828 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADH1C P00326 2/20 0.37
ADH1A P07327 2/20 0.37
ADH1B P00325 1/20 0.37
ADH4 P08319 1/20 0.37
SHBG P04278 1/20 0.37
CYP1A2 P05177 1/20 0.36
EPHX1 P07099 2/20 0.35
KDM4E B2RXH2 2/20 0.35
SIGMAR1 Q99720 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Propane SCHEMBL1169005 0.84 ALDH1A1 (0.75) ALDH1A1HSD17B10THRBATML3MBTL1
SCHEMBL27883700 0.81 KMT2A (0.43) ALDH1A1HSD17B10KMT2AADH1CADH1A
SCHEMBL6292103 0.79 ALDH1A1 (0.52) ALDH1A1HSD17B10KMT2ATHRBATM
Butane SCHEMBL2150295 0.79 ALDH1A1 (0.67) ALDH1A1HSD17B10THRBATML3MBTL1
Butane SCHEMBL2149792 0.79 ALDH1A1 (0.67) ALDH1A1HSD17B10THRBATML3MBTL1
Butane SCHEMBL2150544 0.79 ALDH1A1 (0.67) ALDH1A1HSD17B10THRBATML3MBTL1
Butane SCHEMBL2150537 0.79 ALDH1A1 (0.67) ALDH1A1HSD17B10THRBATML3MBTL1
Ethylamine SCHEMBL1685456 0.79 ALDH1A1 (0.67) ALDH1A1HSD17B10THRBATML3MBTL1
Butane SCHEMBL2149520 0.79 ALDH1A1 (0.67) ALDH1A1HSD17B10THRBATML3MBTL1
Trimethylammonium SCHEMBL28209024 0.78 ALDH1A1 (0.75) ALDH1A1HSD17B10THRBATML3MBTL1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2736509-A1 PROCESS FOR PREPARING PRASUGREL Laboratorios Lesvi, S.L. (ES) 2014-06-04 EP claimed
WO-2013014295-A1 PROCESS FOR PREPARING PRASUGREL LABORATORIOS LESVI, S. L. (ES) 2013-01-31 WO claimed
CN-103733135-B Resist composition, method for forming resist pattern, polyphenol compound used for the same, and alcohol compound derived from the polyphenol compound 三菱瓦斯化学株式会社 2018-11-27 CN disclosed
CN-107924123-A Photoetching material and its manufacture method, photoetching composition, pattern formation method and, compound, resin and their purification process 学校法人关西大学 2018-04-17 CN disclosed
CN-103717562-B Cyclic compound, its manufacture method, compositions and corrosion-resisting pattern forming method 三菱瓦斯化学株式会社 2016-08-24 CN disclosed
CN-103946204-B Cyclic compound, its manufacture method, radiation-sensitive composition and corrosion-resisting pattern forming method 三菱瓦斯化学株式会社 2016-08-24 CN disclosed
US-6143732-A USED AS ANTIVIRAL AGENT AGAINST INFLUENZA VIRUS SHIONOGI & CO., LTD. (JP) 2000-11-07 US disclosed
EP-1024142-A1 NEW SESQUITERPENE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2000-08-02 EP disclosed
US-5876984-A OBTAINED BY CULTURING MICROORGANISM OF STACHYBOTRYS GENUS SHIONOGI & CO., LTD (JP) 1999-03-02 US disclosed
EP-0855398-A1 SESQUITERPENE DERIVATIVES HAVING ANTIVIRAL ACTIVITY SHIONOGI & CO., LTD. (JP) 1998-07-29 EP disclosed
US-4599357-A 1-mercaptoalkanoylindoline-2-carboxylic acids CIBA-GEIGY CORPORATION (US) 1986-07-08 US disclosed
US-4415567-A A 7B-CHROMONE-3-CARBOXAMIDO-2-/4-HYDROXY PHENYL/ACETAMIDO-2-CEPHEM DERIVATIVE EISAI CO., LTD. (JP) 1983-11-15 US disclosed
US-4344944-A 7-α-methoxycephalosporin derivatives, and antibacterial drugs onctaining the same EISAI CO., LTD. (JP) 1982-08-17 US disclosed