SCHEMBL601127

SCHEMBL601127

Cc1cccc(-c2cc(C(N)=NO)nc(C)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 2/20 0.46
ATP4B P51164 2/20 0.46
KMO O15229 3/20 0.43
XDH P47989 1/20 0.43
CSNK1D P48730 1/20 0.41
CSNK1E P49674 1/20 0.41
MAPK14 Q16539 1/20 0.41
LMNA P02545 1/20 0.40
RAB9A P51151 2/20 0.40
PFKFB3 Q16875 2/20 0.39
ADORA2A P29274 2/20 0.38
ADORA1 P30542 2/20 0.38
IDO1 P14902 1/20 0.38
METAP2 P50579 1/20 0.38
DHODH Q02127 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL10223707 1.00 ATP4A (0.46) ATP4AATP4BKMOXDHCSNK1D
SCHEMBL10223679 0.87 KMT2A (0.43) KMOLMNARAB9AADORA2AADORA1
SCHEMBL601102 0.87 KMT2A (0.43) KMOLMNARAB9AADORA2AADORA1
SCHEMBL10223705 0.86 MAPT (0.41) KMORAB9APFKFB3ADORA2AADORA1
SCHEMBL601235 0.86 MAPT (0.41) KMORAB9APFKFB3ADORA2AADORA1
SCHEMBL603684 0.86 ATP4A (0.44) ATP4AATP4BKMOPFKFB3ADORA2A
SCHEMBL10223681 0.86 ATP4A (0.44) ATP4AATP4BKMOPFKFB3ADORA2A
SCHEMBL27865707 0.84 KARS1 (0.40) ATP4AATP4BKMO
SCHEMBL10223699 0.84 KMO (0.41) KMOLMNARAB9AADORA1KDM4E
SCHEMBL601761 0.84 KMO (0.41) KMOLMNARAB9AADORA1KDM4E

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 3 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
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 ATP4A 3719/4885ATP4B 1870/4885KMO 868/4885

“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.