SCHEMBL2494819

SCHEMBL2494819

CCN(CC)c1nc(Cl)nc(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
TSHR P16473 2/20 0.46
ALOX15 P16050 4/20 0.42
ALDH1A1 P00352 3/20 0.42
USP2 O75604 1/20 0.39
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.36
SLC29A1 Q99808 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
MEN1 O00255 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
SCHEMBL1872550 0.95 TDP1 (0.52) TDP1TSHRALOX15ALDH1A1USP2
SCHEMBL28294136 0.95 TDP1 (0.52) TDP1TSHRALOX15ALDH1A1USP2
Hydrochloric Acid SCHEMBL31437540 0.92 TDP1 (0.50) TDP1TSHRALOX15ALDH1A1USP2
Hydrochloric Acid SCHEMBL29191672 0.92 TDP1 (0.50) TDP1TSHRALOX15ALDH1A1USP2
SCHEMBL11787700 0.86 TDP1 (0.41) TDP1TSHRALOX15USP2MAPT
SCHEMBL27361146 0.86 TDP1 (0.41) TDP1TSHRALOX15ALDH1A1USP2
SCHEMBL31717978 0.86 TDP1 (0.41) TDP1TSHRALOX15USP2MAPT
SCHEMBL571574 0.84 MAPT (0.51) TDP1TSHRALOX15ALDH1A1USP2
SCHEMBL11814070 0.84 TDP1 (0.44) TDP1TSHRALOX15ALDH1A1USP2
SCHEMBL5909594 0.81 TDP1 (0.37) TDP1TSHRALOX15ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8330039-B2 Solar cell modules with poly(vinyl butyral) encapsulant comprising unsaturated heterocyclic compound E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-11 US disclosed
EP-2380208-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. du Pont de Nemours and Company (US) 2011-10-26 EP disclosed
WO-2010085664-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-29 WO disclosed
US-20100180947-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-22 US disclosed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 US disclosed
US-7179816-B2 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2007-02-20 US disclosed
US-20060264433-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) ABBOTT LABORATORIES 2006-11-23 US disclosed
EP-1651636-A1 SUBSTITUTED HETEROCYCLIC DIARYLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2006-05-03 EP disclosed
US-20050070575-A1 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2005-03-31 US disclosed
US-6858608-B2 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2005-02-22 US disclosed
US-4415689-A PHOTOSTABILIZERS ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1983-11-15 US disclosed
US-4413999-A CHROMATOGRAPHY, BIOCHEMICAL IMMOBILIZATION, FIBER REACTIVE DYES RESEARCH PRODUCTS REHOVOT LTD. (IL) 1983-11-08 US disclosed
EP-0084849-A2 Water soluble copper complexes of disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1983-08-03 EP disclosed
EP-0074598-A2 Synthetic resin compositions containing 2,2,6,6-tetramethyl piperidinyl triazines ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1983-03-23 EP disclosed
US-4281103-A Dicarboxylic acids containing triazine rings, and polyesters formed from these dicarboxylic acids CIBA-GEIGY CORPORATION (US) 1981-07-28 US disclosed
EP-0025166-A1 Process for preparing vat dyestuffs of the anthraquinone series, their use in dyeing and printing preparations and in dyeing and printing CIBA-GEIGY AG (CH) 1981-03-18 EP disclosed
US-4228281-A PRODUCE THERMOPLASTIC POLYESTERS HAVING HIGH GLASS TRANSITION TEMPERATURES AND HIGH DIMENSIONAL STABILITY UNDER HEAT CIBA-GEIGY CORPORATION (US) 1980-10-14 US disclosed
US-4086204-A LIGHT STABILIZERS CHIMOSA CHIMICA ORGANICA S.P.A. (IT) 1978-04-25 US disclosed
US-4016013-A OR CARBONITRIDESDECOMPOSITION OF TRIAZINE OR PYRIMIDINE COMPOUNDS CIBA-GEIGY CORPORATION (US) 1977-04-05 US disclosed
US-3976603-A Fluorinated elastomeric polymers containing the 1,3,5-triazine ring, and process for preparing same MONTEDISON S.P.A. (IT) 1976-08-24 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 (3 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-20070043049-A1 Substituted heterocyclic diarylamine analogues GPR35, NPY1R, BDKRB1 TDP1 2752/4885TSHR 138/4885ALOX15 2636/4885
US-20060264433-A1 Pharmaceutical compositions as inhibitors of dipeptidyl peptidase-IV (DPP-IV) DPP4, DPP3, DPP7 TDP1 1096/4885TSHR 3551/4885ALOX15 2481/4885
US-20050070575-A1 Chemical derivatives and their application as antitelomerase agents TERT, TERF2, DUT TDP1 85/4885TSHR 3003/4885ALOX15 3394/4885

“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.