SCHEMBL4540450

SCHEMBL4540450

CCCCC(Cl)CCCC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.45
TSHR P16473 6/20 0.40
LMNA P02545 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CYP3A4 P08684 1/20 0.38
THRB P10828 1/20 0.38
FDPS P14324 1/20 0.38
OPRM1 P35372 1/20 0.36
CA2 P00918 2/20 0.36
MAPK1 P28482 1/20 0.36
CA1 P00915 1/20 0.35
TP53 P04637 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
SCHEMBL27574241 0.97 DNM1 (0.43) DNM1TSHRLMNAALDH1A1TDP1
SCHEMBL13451749 0.94 DNM1 (0.48) DNM1TSHRLMNAALDH1A1THRB
SCHEMBL4434367 0.94
SCHEMBL2854096 0.94 DNM1 (0.48) DNM1TSHRLMNAALDH1A1THRB
SCHEMBL18107374 0.91 DNM1 (0.52) DNM1TSHRLMNAALDH1A1THRB
SCHEMBL18107435 0.91 DNM1 (0.52) DNM1TSHRLMNAALDH1A1THRB
SCHEMBL28366749 0.91 DNM1 (0.52) DNM1TSHRLMNAALDH1A1THRB
SCHEMBL14964602 0.91 DNM1 (0.52) DNM1TSHRLMNAALDH1A1THRB
SCHEMBL8063191 0.91 TSHR (0.56) DNM1TSHRLMNAALDH1A1TDP1
SCHEMBL7140554 0.91 DNM1 (0.52) DNM1TSHRLMNAALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005694-A Cyclic nucleoside analogue and preparation method and application thereof 北京双鹤润创科技有限公司 2024-05-10 CN claimed
CN-114149421-A Palmatine derivative, preparation method and antithrombotic application thereof 中国医学科学院医药生物技术研究所 2022-03-08 CN claimed
CN-104230744-B The production method of a kind of Tigecycline bulk drug 湖南尔康制药股份有限公司 2016-06-08 CN claimed
CN-104744292-A Preparation method of -2- ((4-nitrophenylethyl) amino) -2-oxo-1-phenylethyl acetate or derivative thereof NANJING UNIVERSITY OF TECHNOLOGY 2015-07-01 CN claimed
CN-102977170-B Synthesis process for industrial production of capecitabine intermediate NANJING ASIA EAST SUNRISE PHARMACEUTICAL CO LTD 2015-04-22 CN claimed
CN-104230744-A Production method of tigecycline raw medicinal material HUNAN ER KANG PHARMACEUTICAL CO LTD 2014-12-24 CN claimed
CN-103012527-A Novel synthesis process for industrial production of gemcitabine NANJING EAST SUNSCREEN PHARMACEUTICAL CO LTD 2013-04-03 CN claimed
CN-102977170-A Synthesis process for industrial production of capecitabine intermediate NANJING YADONG QITIAN PHARMACEUTICAL CO LTD 2013-03-20 CN claimed
CN-101891678-B 4-(N,N-dimethyl) aminopyridine derivate and synthesis method thereof UNIV SHANGHAI 2012-06-20 CN claimed
CN-101020761-B Ether-ester plasticizers FERRO CORP 2011-07-13 CN claimed
CN-101891678-A 4-(N,N-dimethyl) aminopyridine derivate and synthesis method thereof UNIV SHANGHAI 2010-11-24 CN claimed
CN-101020761-A Ether-ester plasticizers FERRO CORP (US) 2007-08-22 CN claimed
US-20070123622-A1 ETHER-ESTER PLASTICIZERS FERRO CORPORATION (US) 2007-05-31 US claimed
CN-118005694-A Cyclic nucleoside analogue and preparation method and application thereof 北京双鹤润创科技有限公司 2024-05-10 CN disclosed
CN-114149421-A Palmatine derivative, preparation method and antithrombotic application thereof 中国医学科学院医药生物技术研究所 2022-03-08 CN disclosed
CN-106609008-B The synthetic method of the composite modified polystyrene resin of carbon nanotube/carbon black 河北五洲开元环保新材料有限公司 2019-04-05 CN disclosed
US-7498372-B2 Phthalate-free; such as 3-benzyloxy-1,2-propyl dibenzoate; for use with vinyl polymers, rubbers, polyurethanes, and acrylics FERRO CORPORATION (US) 2009-03-03 US disclosed
CN-101020761-A Ether-ester plasticizers FERRO CORP (US) 2007-08-22 CN disclosed
US-20070123622-A1 ETHER-ESTER PLASTICIZERS FERRO CORPORATION (US) 2007-05-31 US disclosed
CN-1844091-A Process for preparing butyl isocyanate JIANGSU ANPON ELECTROCHEMICAL (CN) 2006-10-11 CN disclosed