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(Chloromethyl)Benzene

(Chloromethyl)Benzene

SCHEMBL3200951

C=CC(=O)OCC(C)(C)N.ClCc1ccccc1

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 3/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP2C19 P33261 2/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ SLC6A2 P23975 2/20 0.38
▸ TAAR1 Q96RJ0 1/20 0.38
▸ TGM2 P21980 1/20 0.36
▸ HCAR2 Q8TDS4 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ PDE6D O43924 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
Chloromethane SCHEMBL8427834 0.82 ALDH1A1 (0.59) THRBALDH1A1CYP3A4SMN1; SMN2HIF1A
(Chloromethyl)Benzene SCHEMBL20798103 0.81 THRB (0.47) THRBALDH1A1SMN1; SMN2POLBKMT2A
(Chloromethyl)Benzene SCHEMBL3201628 0.81 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2HIF1ASLC6A2TAAR1
SCHEMBL2046535 0.80 ALDH1A1 (0.61) THRBALDH1A1CYP3A4SMN1; SMN2HIF1A
(Chloromethyl)Benzene SCHEMBL3200943 0.80 CYP2C19 (0.40) THRBALDH1A1CYP3A4SMN1; SMN2HIF1A
(Chloromethyl)Benzene SCHEMBL27131604 0.78 THRB (0.53) THRBALDH1A1CYP3A4HIF1ATP53
Hydrochloric Acid SCHEMBL7804777 0.78 ALDH1A1 (0.59) THRBALDH1A1CYP3A4SMN1; SMN2HIF1A
(Chloromethyl)Benzene SCHEMBL253266 0.78 CYP2C19 (0.40) THRBALDH1A1CYP3A4SMN1; SMN2HIF1A
(Chloromethyl)Benzene SCHEMBL27533618 0.77 ALDH1A1 (0.44) THRBALDH1A1CYP3A4CYP2C19CYP2C9
(Chloromethyl)Benzene SCHEMBL25429849 0.77 MAPT (0.47) THRBALDH1A1CYP3A4SMN1; SMN2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100047404-A1 PACKAGING LAMINATE AKZO NOBEL N.V. (NL) 2010-02-25 — — US claimed
CN-110730841-B Reinforcement system and method for the manufacture of a paper web comprising cellulosic fibers 凯米拉公司 2022-05-17 — — CN disclosed
CN-110730841-A Reinforcement system and method for the manufacture of a paper web comprising cellulosic fibers 凯米拉公司 2020-01-24 — — CN disclosed
US-9869060-B2 Polymer and its preparation and use KEMIRA OYJ (FI) 2018-01-16 — — US disclosed
US-9562327-B2 Process for the production of paper AKZO NOBEL N.V. (NL) 2017-02-07 — — US disclosed
US-20150345079-A1 Polymer and its preparation and use AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2015-12-03 — — US disclosed
CN-104968694-A Polymer and its preparation and use KEMIRA OY 2015-10-07 — — CN disclosed
US-8888957-B2 Process for the production of paper AKZO NOBEL N.V. (NL) 2014-11-18 — — US disclosed
US-20140318727-A1 PROCESS FOR THE PRODUCTION OF PAPER AKZO NOBEL N.V. (NL) 2014-10-30 — — US disclosed
US-20130269894-A1 Process for the production of paper AKZO NOBEL N.V. (NL) 2013-10-17 — — US disclosed
US-8273216-B2 Process for the production of paper AKZO NOBEL N.V. (NL) 2012-09-25 — — US disclosed
EP-2087171-A1 CELLULOSIC PRODUCT Akzo Nobel N.V. (NL) 2009-08-12 — — EP disclosed
WO-2008066488-A1 CELLULOSIC PRODUCT AKZO NOBEL N.V. (NL) 2008-06-05 — — WO disclosed
US-20070151688-A1 Process for the production of paper AKZO NOBEL N.V. (NL) 2007-07-05 — — US disclosed