SCHEMBL600729

SCHEMBL600729

Cc1nc(Cl)cc(-c2ccc(F)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.44
S1PR2 O95136 1/20 0.44
KDM4E B2RXH2 3/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADORA3 P0DMS8 2/20 0.42
ADORA2A P29274 2/20 0.42
ADORA2B P29275 1/20 0.42
ADORA1 P30542 1/20 0.42
CXCL12 P48061 1/20 0.41
PSD A5PKW4 2/20 0.41
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
PFKFB3 Q16875 1/20 0.40

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
SCHEMBL19862096 0.86 MAOA (0.47) RAD51KDM4EMAPTMEN1ALDH1A1
SCHEMBL4748830 0.85 MAPT (0.55) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL908398 0.82 MEN1 (0.52) RAD51S1PR2KDM4EMAPTMEN1
SCHEMBL25068057 0.81 KDM4E (0.58) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL602093 0.81 KDM4E (0.61) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL20222411 0.81 MEN1 (0.55) RAD51KDM4EMAPTMEN1ALDH1A1
SCHEMBL8321136 0.81 RAD51 (0.43) RAD51KDM4EALDH1A1HPGDADORA3
SCHEMBL4716132 0.81 RAD51 (0.48) RAD51KDM4EALDH1A1ADORA3CXCL12
SCHEMBL604498 0.81 PFKFB3 (0.46) KDM4EMAPTMEN1ALDH1A1HPGD
SCHEMBL10685624 0.79 GSK3B (0.46) KDM4EMAPTMEN1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102428082-A Pyrimidine compounds and their use in pest control SUMITOMO CHEMICAL CO 2012-04-25 CN disclosed
EP-2432780-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2012-03-28 EP disclosed
US-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
US-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
US-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
WO-2010134478-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 WO disclosed
US-7091206-B2 Process for producing pyrimidine derivative and intermediate thereof NIPPON SHINYAKU CO., LTD (JP) 2006-08-15 US disclosed
US-7091206-B2 Process for producing pyrimidine derivative and intermediate thereof NIPPON SHINYAKU CO., LTD (JP) 2006-08-15 US disclosed
EP-1318146-B1 PROCESS FOR PRODUCING PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF NIPPON SHINYAKU CO LTD (JP) 2005-02-23 EP disclosed
EP-1318146-B1 PROCESS FOR PRODUCING PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF NIPPON SHINYAKU CO LTD (JP) 2005-02-23 EP disclosed
EP-0781766-B1 HETEROCYCLIC DERIVATIVE AND MEDICINE NIPPON SHINYAKU CO LTD (JP) 2004-03-31 EP disclosed
US-20040023985-A1 Process for producing pyrimidine derivative and intermediate thereof NIPPON SHINYAKU CO., LTD. (JP) 2004-02-05 US disclosed
US-20040023985-A1 Process for producing pyrimidine derivative and intermediate thereof NIPPON SHINYAKU CO., LTD. (JP) 2004-02-05 US disclosed
CN-1118454-C Heterocyclic derivative and medicine NIPPON SHINYAKU CO LTD (JP) 2003-08-20 CN disclosed
EP-1318146-A1 PROCESS FOR PRODUCING PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF Nippon Shinyaku Co., Ltd. (JP) 2003-06-11 EP disclosed
EP-1318146-A1 PROCESS FOR PRODUCING PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF Nippon Shinyaku Co., Ltd. (JP) 2003-06-11 EP disclosed
WO-2002020494-A1 PROCESS FOR PRODUCING PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF NIPPON SHINYAKU CO., LTD. (JP) 2002-03-14 WO disclosed
US-6191149-B1 DRUG FOR CEREBROVASCULAR DISEASE NIPPON SHINYAKU, CO., LTD. (JP) 2001-02-20 US disclosed
US-5945426-A PREVENT NEURONAL DEATH NIPPON SHINYAKU CO., LTD. (JP) 1999-08-31 US disclosed
EP-0781766-A1 HETEROCYCLIC DERIVATIVE AND MEDICINE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1997-07-02 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 (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-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL TYMP, DPYD, TYMS RAD51 1025/4885S1PR2 794/4885KDM4E 1030/4885

“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.