SCHEMBL4357019

SCHEMBL4357019

C=C(c1ccccc1)c1ccc(C#N)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
CA2 P00918 3/20 0.47
MAOB P27338 3/20 0.47
CA1 P00915 2/20 0.47
MAOA P21397 2/20 0.47
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.45
ATM Q13315 1/20 0.45
CA12 O43570 1/20 0.44
CA3 P07451 1/20 0.44
CA6 P23280 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
NPC1 O15118 2/20 0.42

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
SCHEMBL9272877 0.91 CA2 (0.54) TSHRALDH1A1MAPTLMNACA2
SCHEMBL19916025 0.90 MMP3 (0.50) TSHRKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL2179897 0.82 TSHR (0.59) TSHRKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL21783604 0.82 TSHR (0.59) TSHRKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL21783558 0.82 TSHR (0.59) TSHRKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL23456757 0.82 TSHR (0.59) TSHRKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL21783611 0.82 TSHR (0.59) TSHRKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9693267 0.81 MAOA (0.53) TSHRKMT2AMEN1ALDH1A1MAPT
SCHEMBL894135 0.81 MEN1 (0.65) TSHRKMT2AMEN1ALDH1A1L3MBTL1
Water SCHEMBL5208115 0.81 KMT2A (0.58) TSHRKMT2AMEN1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023171597-A1 HIGH-PURITY 4-(2-BROMOETHYL)BENZENESULFONIC ACID, HIGH-PURITY STYRENESULFONIC ACIDS DERIVED THEREFROM AND POLYMERS THEREOF, AND METHODS FOR PRODUCING SAME 東ソー・ファインケム株式会社 2023-09-14 WO disclosed
US-11578028-B2 Surfactant composition DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2023-02-14 US disclosed
US-11459410-B2 High-purity amphipathic arylsulfonic acid amine salt vinyl monomer and copolymer thereof TOSOH FINECHEM CORPORATION (JP) 2022-10-04 US disclosed
CN-110997631-B High purity amphiphilic arylsulfonic acid amine salt vinyl monomers and (co) polymers thereof 东曹精细化工株式会社 2022-07-15 CN disclosed
CN-109790369-B Surfactant composition 第一工业制药株式会社 2022-01-04 CN disclosed
CN-113597439-A Novel polystyrene-based amphoteric polyelectrolytes having a maximum critical eutectic temperature and uses thereof 东曹精细化工株式会社 2021-11-02 CN disclosed
EP-3508269-B1 SURFACTANT COMPOSITION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2021-06-23 EP disclosed
CN-109890495-B Surfactant composition 第一工业制药株式会社 2021-04-20 CN disclosed
US-10940453-B2 Surfactant composition DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2021-03-09 US disclosed
EP-3508532-B1 SURFACTANT COMPOSITION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2020-12-23 EP disclosed
US-8487060-B2 Method for producing polychloroprene latex, polychloroprene latex, and adhesive using the same DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2013-07-16 US disclosed
US-20120172523-A1 METHOD OF PRODUCING A CHLOROPRENE-BASED POLYMER, POLYCHLOROPRENE LATEX AND ADHESIVE COMPOSITION TOHOKU UNIVERSITY (JP) 2012-07-05 US disclosed
US-20120142859-A1 METHOD FOR PRODUCING POLYCHLOROPRENE LATEX, POLYCHLOROPRENE LATEX, AND ADHESIVE USING THE SAME TOHOKU UNIVERSITY (JP) 2012-06-07 US disclosed
CN-101754974-A Macrocyclic compounds as antiviral agents ANGELETTI P IST RICHERCHE BIO 2010-06-23 CN disclosed
US-20090036608-A1 CHLOROPRENE-BASED BLOCK COPOLYMER, SOAPLESS POLYCHLOROPRENE-BASED LATEX, AND PROCESSES FOR PRODUCING THE SAME TOSOH CORPORATION (JP) 2009-02-05 US disclosed
US-20080125572-A1 POLYCHLOROPRENE-BASE LATEX AND METHOD FOR PRODUCING IT TOSOH CORPORATION (JP) 2008-05-29 US disclosed
EP-1446371-A1 METHOD FOR THE PRODUCTION OF VINYL-ARENES, -HETEROARENES AND 1,3-DIENES FROM ARYL-, HETEROARYL- OR VINYL-CARBOXYLIC ACID DERIVATIVES Studiengesellschaft Kohle mbH (DE) 2004-08-18 EP disclosed
WO-2003043958-A1 METHOD FOR THE PRODUCTION OF VINYL-ARENES, -HETEROARENES AND 1,3-DIENES FROM ARYL-, HETEROARYL- OR VINYL-CARBOXYLIC ACID DERIVATIVES STUDIENGESELLSCHAFT KOHLE MBH (DE) 2003-05-30 WO disclosed
US-5112851-A Agricultural Fungicides SANDOZ LTD. (CH) 1992-05-12 US disclosed
US-4939148-A Amine derivatives, processes for their production and their use SANDOZ, LTD. (CH) 1990-07-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11459410-B2 High-purity amphipathic arylsulfonic acid amine salt vinyl monomer and copolymer thereof SLC7A1, ARSA, STS TSHR 2323/4885KMT2A 1480/4885MEN1 4684/4885
US-11578028-B2 Surfactant composition CHRM1, DEGS1, ASH2L TSHR 3916/4885KMT2A 866/4885MEN1 2495/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.