SCHEMBL603770

SCHEMBL603770

Cc1nc(C#N)cc(-c2ccc(F)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.51
SQOR Q9Y6N5 3/20 0.49
SCN9A Q15858 3/20 0.47
HPGD P15428 6/20 0.45
MAPT P10636 5/20 0.45
ALDH1A1 P00352 5/20 0.45
GAA P10253 3/20 0.45
GLA P06280 2/20 0.45
PKM P14618 1/20 0.45
ATM Q13315 1/20 0.45
CSNK2A1 P68400 1/20 0.45
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43

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
SCHEMBL601167 0.86 KDM4E (0.50) KDM4EHPGDMAPTALDH1A1GAA
SCHEMBL603951 0.83 MAPT (0.58) KDM4ESQORHPGDMAPTALDH1A1
SCHEMBL603975 0.83 KDM4E (0.59) KDM4ESQORHPGDMAPTALDH1A1
SCHEMBL603342 0.83 KDM4E (0.48) KDM4ESQORHPGDMAPTALDH1A1
SCHEMBL19862096 0.82 MAOA (0.47) KDM4EHPGDMAPTALDH1A1GAA
SCHEMBL27848601 0.80 MAPT (0.45) KDM4EHPGDMAPTALDH1A1GAA
SCHEMBL8321136 0.77 RAD51 (0.43) KDM4EHPGDALDH1A1ADORA2AADORA1
SCHEMBL20222411 0.77 MEN1 (0.55) KDM4EHPGDMAPTALDH1A1GAA
SCHEMBL26659404 0.77 SCN9A (0.53) KDM4ESQORSCN9AHPGDMAPT
SCHEMBL17987293 0.75 MAOA (0.39) KDM4EHPGDMAPTALDH1A1GAA

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 6 patents. 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

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 KDM4E 1030/4885SQOR 853/4885SCN9A 2911/4885

“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.