SCHEMBL602372

SCHEMBL602372

Cc1nc(Cl)cc(-c2ccccc2C)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.46
HSP90AB1 P08238 3/20 0.46
IDO1 P14902 1/20 0.41
METAP2 P50579 1/20 0.41
NPC1 O15118 6/20 0.40
RAB9A P51151 6/20 0.40
KMT2A Q03164 5/20 0.40
CYP1A2 P05177 5/20 0.40
CYP2C19 P33261 5/20 0.40
ALDH1A1 P00352 4/20 0.40
CYP2D6 P10635 4/20 0.40
MEN1 O00255 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 3/20 0.40
CYP3A4 P08684 3/20 0.40
HSD17B10 Q99714 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
CLK4 Q9HAZ1 2/20 0.40
LMNA P02545 2/20 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
SCHEMBL21058449 0.85 HSP90AA1 (0.46) HSP90AA1HSP90AB1IDO1METAP2NPC1
SCHEMBL6586882 0.85 HSP90AA1 (0.64) HSP90AA1HSP90AB1IDO1NPC1RAB9A
SCHEMBL602995 0.82 MAPK14 (0.45) HSP90AA1HSP90AB1NPC1RAB9ACASP3
SCHEMBL3952089 0.82 HSP90AA1 (0.70) HSP90AA1HSP90AB1KMT2AKDM4ECLK4
SCHEMBL29571104 0.82 HSP90AA1 (0.70) HSP90AA1HSP90AB1KMT2AKDM4ECLK4
SCHEMBL25068017 0.82 KDM4E (0.46) HSP90AA1HSP90AB1NPC1RAB9AKMT2A
SCHEMBL15840233 0.81 LMNA (0.62) HSP90AA1HSP90AB1NPC1RAB9AKMT2A
SCHEMBL4277914 0.80 AGPAT2 (0.50) HSP90AA1HSP90AB1IDO1ALDH1A1CYP3A4
SCHEMBL24324597 0.79 HSP90AA1 (0.46) HSP90AA1HSP90AB1NPC1RAB9AKMT2A
SCHEMBL27865668 0.78 DPP4 (0.46) HSP90AA1HSP90AB1NPC1RAB9AKMT2A

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 HSP90AA1 3094/4885HSP90AB1 3128/4885IDO1 633/4885

“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.