SCHEMBL660859

SCHEMBL660859

CCc1cc(CC)cc(CC)c1.N=C=O.N=C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
PTGS2 P35354 1/20 0.37
TP53 P04637 1/20 0.35
CYP2A6 P11509 2/20 0.33
TRPA1 O75762 1/20 0.33
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A2 P05177 1/20 0.32
CA2 P00918 1/20 0.31
HSPA5 P11021 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
LOXL2 Q9Y4K0 1/20 0.30

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
SCHEMBL1845732 0.90 PGK1 (0.40) RXRARXRBPTGS2ALDH1A1MAPK1
SCHEMBL28260117 0.85 PGK1 (0.35) RXRARXRBPTGS2ALDH1A1MAPK1
SCHEMBL28071532 0.85 TP53 (0.46) PTGS2TP53CYP2A6TRPA1ALDH1A1
SCHEMBL27843039 0.85 TP53 (0.46) PTGS2TP53CYP2A6TRPA1ALDH1A1
SCHEMBL10589081 0.82 CYP2A6 (0.50) TP53CYP2A6ALDH1A1LMNAMAPK1
SCHEMBL3348229 0.82 CYP2A6 (0.50) TP53CYP2A6ALDH1A1LMNAMAPK1
SCHEMBL439074 0.80 PTGS2 (0.48) RXRARXRBPTGS2TP53CYP2A6
SCHEMBL28806252 0.80 PTGS2 (0.48) RXRARXRBPTGS2TP53CYP2A6
SCHEMBL3196057 0.78 RXRA (0.36) RXRARXRBPTGS2TP53CYP2A6
Formaldehyde SCHEMBL27639175 0.78 RXRA (0.43) RXRARXRBPTGS2TP53CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108059705-B Aqueous polyurethane resin hydrolysis-resistant agent and preparation method and application thereof 上海华峰新材料研发科技有限公司 2020-08-28 CN claimed
CN-108059705-A Waterborne polyurethane resin hydrolysis agent and its preparation method and application 上海华峰新材料研发科技有限公司 2018-05-22 CN claimed
EP-2666805-B1 Method for manufacturing a fibre compound material LANXESS DEUTSCHLAND GMBH (DE) 2014-10-22 EP claimed
CN-108059705-B Aqueous polyurethane resin hydrolysis-resistant agent and preparation method and application thereof 上海华峰新材料研发科技有限公司 2020-08-28 CN disclosed
US-20190119445-A1 NOVEL COMPOSITIONS FOR PRODUCING CAST POLYAMIDES LANXESS DEUTSCHLAND GMBH (DE) 2019-04-25 US disclosed
CN-108059705-A Waterborne polyurethane resin hydrolysis agent and its preparation method and application 上海华峰新材料研发科技有限公司 2018-05-22 CN disclosed
US-9452975-B2 Biobased carbodiimides, a process for preparation thereof and use thereof RHEIN CHEMIE RHEINAU GMBH (DE) 2016-09-27 US disclosed
US-20150051368-A1 NOVEL COMPOSITIONS FOR PRODUCING CAST POLYAMIDES LANXESS DEUTSCHLAND GMBH (DE) 2015-02-19 US disclosed
US-20140323754-A1 BIOBASED CARBODIIMIDES, A PROCESS FOR PREPARATION THEREOF AND USE THEREOF RHEIN CHEMIE RHEINAU GMBH (DE) 2014-10-30 US disclosed
US-8772387-B2 Dispersion adhesives, a process for preparing them and use thereof RHEIN CHEMIE RHEINAU GMBH (DE) 2014-07-08 US disclosed
US-8765260-B2 Bonding agents based on carbodiimides, aqueous resorcinol-formaldehyde-latex dispersions comprising bonding agent, adhesion-improved fibres, processes for production thereof and use thereof RHEIN CHEMIE RHEINAU GMBH (DE) 2014-07-01 US disclosed
US-20120043505-A1 Transformer oil composition, comprising at least one acid interceptor RHEIN CHEMIE RHEINAU GMBH (DE) 2012-02-23 US disclosed
US-20110318586-A1 Innovative flexible packaging forms, method for producing them and use thereof RHEIN CHEMIE RHEINAU GMBH (DE) 2011-12-29 US disclosed
US-20110092620-A1 Carbodiimides and 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl-4-methylphenyl] acrylate as colour stabilizers in hot-melt adhesives RHEIN CHEMIE RHEINAU GMBH (DE) 2011-04-21 US disclosed
US-20090306332-A1 PREPARATION OF CAST POLYAMIDES USING SPECIAL ACTIVATORS RHEIN CHEMIE RHEINAU GMBH (DE) 2009-12-10 US disclosed
US-7291683-B2 Mixture of polyamide, polyester with (poly)carbodiimide; molding materials RHEIN CHEMIE RHEINAU GMBH (DE) 2007-11-06 US disclosed
US-20050049363-A1 Compatible blends of thermoplastic molding compositions LANXESS DEUTSCHLAND GMBH (DE) 2005-03-03 US disclosed
US-6498225-B2 POLYDICARBODIIMIDE BLOCK COPOLYMERIZED WITH POLYETHER, POLYDIAMINES, POLYDIMERCAPTANS, POLYAMINOALCOHOLS, POLYAMINOMERCAPTANS AND POLYMERCAPTOALCOHOLS; HIGH EFFICIENCY AT LOW DOSAGE AS HYDROLYSIS PROTECTION OF POLYESTERS RHEIN CHEMIE RHEINAU GMBH (DE) 2002-12-24 US disclosed
US-20010037010-A1 Polycarbodiimide-based block copolymers, a method of preparing them and their use as hydrolysis stabilizers RHEIN CHEMIE RHEINAU GMBH (DE) 2001-11-01 US disclosed
US-5031539-A Radiation curable rocket motor liner for case bonded solid propellant THIOKOL CORPORATION (US) 1991-07-16 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 (1 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-20140323754-A1 BIOBASED CARBODIIMIDES, A PROCESS FOR PREPARATION THEREOF AND USE THEREOF OTUB1, CBR3, BBOX1 RXRA 4370/4885RXRB 4437/4885PTGS2 1118/4885

“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.