SCHEMBL653958

SCHEMBL653958

Nc1nc(Cl)c(N)c(Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
DPP4 P27487 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
ADORA2A P29274 3/20 0.37
ADORA1 P30542 3/20 0.37
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
CHUK O15111 1/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 2/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CASP1 P29466 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
HTR2B P41595 1/20 0.30
PDE4D Q08499 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
SCHEMBL1512060 0.84 DPP4 (0.35) MEN1KMT2AHTTDPP4TDP1
SCHEMBL29419387 0.84 DPP4 (0.35) MEN1KMT2AHTTDPP4TDP1
Hydrochloric Acid SCHEMBL1512064 0.82 DPP4 (0.34) MEN1KMT2AHTTDPP4TDP1
SCHEMBL9178364 0.80 KDM4E (0.40) MEN1KMT2ATDP1ADORA2AADORA1
SCHEMBL9192133 0.80 TDP1 (0.35) MEN1KMT2AHTTDPP4TDP1
SCHEMBL5261298 0.79 TDP1 (0.42) MEN1KMT2ADPP4TDP1ADORA2A
SCHEMBL2072565 0.79 ALDH1A1 (0.47) MEN1KMT2AHTTTDP1LMNA
SCHEMBL24862134 0.76 GOT1 (0.32) MEN1KMT2AHTTDPP4CHUK
SCHEMBL11061973 0.74 GLP1R (0.44) DPP4ADORA2AADORA1LMNA
SCHEMBL22039133 0.74 PTPN1 (0.38) MEN1KMT2ADPP4ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119912457-A Pyrimidine triazole compound as well as preparation method and application thereof 郑州大学 2025-05-02 CN claimed
CN-106432330-B The midbody compound and its preparation method and application of LB80380 drug 天津科伦药物研究有限公司 2019-02-01 CN claimed
EP-3226861-A2 COMPOUNDS FOR TREATING CYSTIC FIBROSIS Centre National de la Recherche Scientifique (CNRS) (FR) 2017-10-11 EP claimed
WO-2016087665-A2 COMPOUNDS FOR TREATING CYSTIC FIBROSIS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2016-06-09 WO claimed
EP-2680847-A1 PYRIMIDINE COMPOUNDS INHIBITING THE FORMATION OF NITRIC OXIDE AND PROSTAGLANDIN E2, METHOD OF PRODUCTION THEREOF AND USE THEREOF Ustav Organicke Chemie A Biochemie Akademie Ved Cr, v.v.i. (CZ) 2014-01-08 EP claimed
US-20130324566-A1 PYRIMIDINE COMPOUNDS INHIBITING THE FORMATION OF NITRIC OXIDE AND PROSTAGLANDIN E2, METHOD OF PRODUCTION THEREOF AND USE THEREOF USTAV EXPERIMENTALNI MEDICINY AKADEMIE VED CR, v.v.i. (CZ) 2013-12-05 US claimed
WO-2012116666-A1 PYRIMIDINE COMPOUNDS INHIBITING THE FORMATION OF NITRIC OXIDE AND PROSTAGLANDIN E2, METHOD OF PRODUCTION THEREOF AND USE THEREOF USTAV ORGANICKE CHEMIE A BIOCHEMIE AKADEMIE VED CR, v.v.i. (CZ) 2012-09-07 WO claimed
CN-102098918-A Bioactive compounds for treatment of cancer and neurodegenerative diseases PONIARD PHARMACEUTICALS INC 2011-06-15 CN claimed
EP-2273882-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES Poniard Pharmaceuticals, Inc. (US) 2011-01-19 EP claimed
CN-101130542-B Synthesis of antiviral nucleoside analogues JIANGSU CHIA TAI TIANQING PHAR 2010-08-04 CN claimed
EP-0741710-B1 CHLOROPYRIMIDINE INTERMEDIATES WELLCOME FOUND (GB) 2000-05-10 EP claimed
US-5917042-A Process for the preparation of 2,5-diamino-4,6-dichloropyrimidine GLAXO WELLCOME INC. (US) 1999-06-29 US claimed
EP-0816344-A1 Process for the production of 2,5-diamino-4,6-dichloropyrimidine LONZA AG (CH) 1998-01-07 EP claimed
US-5693800-A N-(2-amino-4,6-dichloropyrimidine-5-yl) formamide and a process for its preparation LONZA AG (CH) 1997-12-02 US claimed
EP-0552758-B1 N-5-protected 2,5-diamino-4,6-dichloropyrimidines and process for their preparation LONZA AG (CH) 1997-06-11 EP claimed
EP-0684236-A2 N-(2-Amino-4,6-dichloropyrimidin-5-yl)formamide and process for its production LONZA AG (CH) 1995-11-29 EP claimed
WO-1995021161-A1 CHLOROPYRIMIDE INTERMEDIATES THE WELLCOME FOUNDATION LIMITED (GB) 1995-08-10 WO claimed
US-5294710-A N-5-protected 2,5-diamino-4,6-dichloropyrimidines and process for their production LONZA LTD. (CH) 1994-03-15 US claimed
CN-1077193-A N-5 position-protected 2,5-diamino-4,6-dichloro pyrimidine and production method thereof LONZA AG (CH) 1993-10-13 CN claimed
EP-0552758-A1 N-5-protected 2,5-diamino-4,6-dichloropyrimidines and process for their preparation LONZA AG (CH) 1993-07-28 EP claimed

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-20130324566-A1 PYRIMIDINE COMPOUNDS INHIBITING THE FORMATION OF NITRIC OXIDE AND PROSTAGLANDIN E2, METHOD OF PRODUCTION THEREOF AND USE THEREOF PTGIS, PTGS2, PTGES2 MEN1 4147/4885KMT2A 4035/4885HTT 4722/4885

“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.