Sugi Predict

Sugi Predict / Compounds / SCHEMBL990405

SCHEMBL990405

SCHEMBL990405

CCCCC(CC)COC(=O)CCc1cc(-c2ccc(Cl)cc2-c2c[nH]nn2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ CYP3A4 P08684 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ ATM Q13315 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ LMNA P02545 2/20 0.33
▸ CA2 P00918 1/20 0.32
▸ GAA P10253 2/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ XBP1 P17861 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.30
▸ LTA4H P09960 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
SCHEMBL3005960 0.91 CYP3A4 (0.40) ALDH1A1MAPK1CYP3A4TSHRATM
SCHEMBL7647071 0.89 ALDH1A1 (0.40) ALDH1A1MAPK1CYP3A4TSHRATM
SCHEMBL3919073 0.87 EPHX2 (0.37) ALDH1A1TDP1GAAKMT2AL3MBTL1
SCHEMBL17627924 0.83 ALDH1A1 (0.46) ALDH1A1MAPK1CYP3A4TSHRATM
SCHEMBL991097 0.83 GAA (0.40) ALDH1A1LMNAGAAKMT2A
SCHEMBL7226047 0.83 ALDH1A1 (0.33) ALDH1A1MAPK1
SCHEMBL4887850 0.81 CYP3A4 (0.39) ALDH1A1MAPK1CYP3A4TSHRATM
SCHEMBL6928491 0.80 ALDH1A1 (0.42) ALDH1A1MAPK1CYP3A4TSHRATM
SCHEMBL7760490 0.80 ALDH1A1 (0.38) ALDH1A1MAPK1CYP3A4TSHRATM
SCHEMBL7647067 0.79 ALDH1A1 (0.39) ALDH1A1MAPK1CYP3A4TSHRATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9546261-B2 Stabilizing of organic material with amino-triazine based mannich-compounds BOREALIS AG (AT) 2017-01-17 — — US disclosed
US-20140336312-A1 STABILIZER MIXTURE BASF SE (DE) 2014-11-13 — — US disclosed
US-8822575-B2 Stabilizer mixture BASF SE (DE) 2014-09-02 — — US disclosed
US-20140235766-A1 Stabilizing of Organic Material with Amino-Triazine Based Mannich-Compounds BOREALIS AG (AT) 2014-08-21 — — US disclosed
EP-2758462-A1 STABILIZING OF ORGANIC MATERIAL WITH AMINO-TRIAZINE BASED MANNICH-COMPOUNDS Borealis AG (AT) 2014-07-30 — — EP disclosed
WO-2013041592-A1 STABILIZING OF ORGANIC MATERIAL WITH AMINO-TRIAZINE BASED MANNICH-COMPOUNDS BOREALIS AG (AT) 2013-03-28 — — WO disclosed
US-8303851-B2 Stabilizers, organic or inorganic pigments, and/orone or more dyes, obtained by extrusion at lowest melting temperature GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2012-11-06 — — US disclosed
EP-2456817-A1 DERIVATIVES OF DIPHOSPHINES AS FLAME RETARDANTS IN AROMATIC AND/OR HETEROAROMATIC EPOXY RESINS BASF SE (DE) 2012-05-30 — — EP disclosed
US-20110130493-A1 STABILIZER MIXTURE BASF SE (DE) 2011-06-02 — — US disclosed
WO-2011009876-A1 DERIVATIVES OF DIPHOSPHINES AS FLAME RETARDANTS IN AROMATIC AND/OR HETEROAROMATIC EPOXY RESINS BASF SE (DE) 2011-01-27 — — WO disclosed
US-20090029121-A1 NANOPARTICULATE METAL BORIDE COMPOSITION AND ITS USE FOR IDENTIFICATION-MARKING PLASTIC PARTS BASF SE (DE) 2009-01-29 — — US disclosed
US-20080194766-A1 Mixtures of Additives For Organic Polymers In Granular Form GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2008-08-14 — — US disclosed
US-20080167189-A1 Polymer Compositions and Their Use in the Production of Active or Effective Ingredient Compositions BASF AKTIENGESELLSCHAFT (DE) 2008-07-10 — — US disclosed
EP-1097965-B1 Mixtures of additives for organic polymers in granular form GREAT LAKES CHEMICAL EUROP (CH) 2005-03-30 — — EP disclosed
EP-0885924-B1 Improved monofilament TEIJIN MONOFILAMENT GER GMBH (DE) 2003-12-03 — — EP disclosed
EP-1097965-A1 Mixtures of additives for organic polymers in granular form Great Lakes Chemical (Europe) GmbH (CH) 2001-05-09 — — EP disclosed
US-5985961-A POLYESTER MONOFILAMENTS OF COPOLYESTERS, CARBON BLACK, ANTIOXIDANTS JOHNS MANVILLE INTERNATIONAL, INC. (US) 1999-11-16 — — US disclosed
US-5969014-A UNIFORMLY INCORPORATING STEARICALLY HINDERED PHENYL PHOSPHONITE AND NONHYDROXYL SUBSTITUTED OXANILIDE; EXTRUDED ARTICLES, FIBERS EXHIBITING OUTSTANDING COLOR BRIGHTNESS AND COLOR STABILITY CLARIANT FINANCE (BVI) LIMITED (VG) 1999-10-19 — — US disclosed
US-5965261-A Polyester CLARIANT FINANCE (BVI) LIMITED (VG) 1999-10-12 — — US disclosed
EP-0885924-A2 Improved monofilament HOECHST CELANESE CORPORATION (US) 1998-12-23 — — EP 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-20140235766-A1 Stabilizing of Organic Material with Amino-Triazine Based Mannich-Compounds PCNA, SOD1, UBE2M ALDH1A1 3108/4885MAPK1 3623/4885CYP3A4 3585/4885
US-20080167189-A1 Polymer Compositions and Their Use in the Production of Active or Effective Ingredient Compositions GANC, PHOSPHO1, PGLS ALDH1A1 4263/4885MAPK1 2104/4885CYP3A4 3816/4885

“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.