SCHEMBL603720

SCHEMBL603720

Cc1cccc(-c2cc(Cl)nc(C)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.46
IDO1 P14902 1/20 0.45
METAP2 P50579 1/20 0.45
PFKFB3 Q16875 2/20 0.44
KDM4E B2RXH2 3/20 0.43
RAB9A P51151 2/20 0.43
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
NPC1 O15118 1/20 0.43
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL12264969 0.87 XDH (0.53) XDHIDO1METAP2PFKFB3KDM4E
SCHEMBL25068234 0.84 KDM4E (0.50) KDM4ERAB9AHSP90AA1HSP90AB1NPC1
SCHEMBL602093 0.83 KDM4E (0.61) KDM4ERAB9AHSP90AA1HSP90AB1MAPT
SCHEMBL604498 0.83 PFKFB3 (0.46) IDO1PFKFB3KDM4EHSP90AA1HSP90AB1
SCHEMBL9920523 0.81 RAB9A (0.53) XDHIDO1METAP2PFKFB3KDM4E
SCHEMBL17051653 0.81 KMT2A (0.53) XDHKDM4ERAB9ANPC1MAPT
SCHEMBL22883197 0.80 LMNA (0.58) XDHIDO1METAP2KDM4ERAB9A
SCHEMBL9911109 0.80 MEN1 (0.53) XDHIDO1METAP2PFKFB3KDM4E
SCHEMBL25068057 0.80 KDM4E (0.58) KDM4ERAB9AHSP90AA1HSP90AB1MAPT
SCHEMBL4748830 0.79 MAPT (0.55) KDM4EHSP90AA1HSP90AB1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 XDH 339/4885IDO1 633/4885METAP2 499/4885

“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.