SCHEMBL2811158

SCHEMBL2811158

CC=C(C)C(=O)OC1CC(C)(C)N(C)C(C)(C)C1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 1/20 0.36
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 1/20 0.35
ESR1 P03372 1/20 0.35
GAA P10253 2/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
LMNA P02545 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
SCHEMBL4921204 1.00 TSHR (0.37) TSHRKMT2AMAPTHSD17B10ALDH1A1
SCHEMBL27782655 0.89 TSHR (0.35) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL5606458 0.88 TSHR (0.37) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL11840304 0.86 TSHR (0.33) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL23010388 0.84 ALDH1A1 (0.33) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL67638 0.84 TSHR (0.39) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL8854706 0.84 TSHR (0.39) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL28201078 0.83 TSHR (0.38) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL985161 0.82 TSHR (0.50) TSHRKMT2AHSD17B10ALDH1A1ESR1
SCHEMBL14283326 0.82 KMT2A (0.33) TSHRKMT2AHSD17B10ALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110225933-B Aqueous polyurethane resin composition 株式会社艾迪科 2021-11-19 CN disclosed
CN-108350309-A Aqueous resin coating composition, heat-ray shielding film using same, and method for producing same 株式会社ADEKA 2018-07-31 CN disclosed
US-9546261-B2 Stabilizing of organic material with amino-triazine based mannich-compounds BOREALIS AG (AT) 2017-01-17 US disclosed
US-9546261-B2 Stabilizing of organic material with amino-triazine based mannich-compounds BOREALIS AG (AT) 2017-01-17 US disclosed
CN-103140555-B The coating product of anti-flammability coating material aqueous polyurethane resin combination and coating said composition ADEKA CORP. (JP) 2016-06-01 CN disclosed
CN-103649143-B Water-soluble polyurethane resin composition and easily adhesive polyester film coated with same ADEKA CORP. (JP) 2016-04-20 CN disclosed
EP-2210918-B1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE ADEKA CORP (JP) 2015-01-14 EP disclosed
CN-103189408-B Water-based polyurethane resin composition, coating material using said composition, and coated article ADEKA CORP 2015-01-07 CN disclosed
US-20140235766-A1 Stabilizing of Organic Material with Amino-Triazine Based Mannich-Compounds BOREALIS AG (AT) 2014-08-21 US disclosed
US-20140235766-A1 Stabilizing of Organic Material with Amino-Triazine Based Mannich-Compounds BOREALIS AG (AT) 2014-08-21 US disclosed
CN-101855301-B Resin composition and resin molded article ADEKA CORP 2012-05-30 CN disclosed
CN-101855301-A Resin composition and resin molded article ADEKA CORP 2010-10-06 CN disclosed
US-20100249289-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE ADEKA CORPORATION (JP) 2010-09-30 US disclosed
EP-2210918-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE Adeka Corporation (JP) 2010-07-28 EP disclosed
US-20090312464-A1 Stabilizer mixtures GUGUMUS FRANCOIS 2009-12-17 US disclosed
US-20080103282-A1 Aqueous Dispersion Type Polyurethane Composition ADEKA CORPORATION (JP) 2008-05-01 US disclosed
US-7332105-B2 Synergistic UV absorber combination CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-02-19 US disclosed
US-7169835-B2 Stabilizer mixture CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-30 US disclosed
CN-1226906-A Triblock oligomers, thermoplastic resin compositions, and antifog moldings MITSUI CHEMICALS INC (JP) 1999-08-25 CN 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-20140235766-A1 Stabilizing of Organic Material with Amino-Triazine Based Mannich-Compounds PCNA, SOD1, UBE2M TSHR 4491/4885KMT2A 1629/4885MAPT 97/4885

“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.