SCHEMBL602791

SCHEMBL602791

CC(C)c1nc(C(N)=NO)cc(-c2ccccc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
ADORA1 P30542 6/20 0.39
ADORA2A P29274 4/20 0.39
ADORA3 P0DMS8 2/20 0.39
ADORA2B P29275 1/20 0.39
GLA P06280 2/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
HPGD P15428 3/20 0.36
TSHR P16473 2/20 0.36
GAA P10253 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 2/20 0.35
AGTR1 P30556 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL10223738 1.00 KDM4E (0.39) KDM4EADORA1ADORA2AADORA3ADORA2B
SCHEMBL10223679 0.81 KMT2A (0.43) KDM4EADORA1ADORA2AGLAHTT
SCHEMBL601102 0.81 KMT2A (0.43) KDM4EADORA1ADORA2AGLAHTT
SCHEMBL17563610 0.78 MEN1 (0.54) KDM4EADORA1ADORA2AADORA3ADORA2B
SCHEMBL22623614 0.73 MEN1 (0.44) KDM4EADORA1ADORA2AADORA3ADORA2B
SCHEMBL602886 0.73 KDM4E (0.38) KDM4EADORA1ADORA2AADORA3ADORA2B
SCHEMBL10223722 0.73 KDM4E (0.38) KDM4EADORA1ADORA2AADORA3ADORA2B
SCHEMBL12455078 0.72 ALDH1A1 (0.46) KDM4EADORA1ADORA2AADORA3ADORA2B
SCHEMBL14667328 0.71 KMO (0.60) KMT2ATSHRMAPTSMN1; SMN2
SCHEMBL10223595 0.71 CYP3A4 (0.36) TSHRMAPTSMN1; SMN2NPSR1

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 4 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
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 1030/4885ADORA1 372/4885ADORA2A 367/4885

“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.