SCHEMBL375243

SCHEMBL375243

Fc1cccc(-c2nc(Cl)c(Cl)c(Cl)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
NT5E P21589 1/20 0.45
IDO1 P14902 1/20 0.43
DPP4 P27487 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPT P10636 1/20 0.42
TP53 P04637 1/20 0.41
HTT P42858 2/20 0.41
TAAR1 Q96RJ0 1/20 0.41
ESR2 Q92731 1/20 0.41
HPGDS O60760 2/20 0.41
ALDH1A1 P00352 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 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
SCHEMBL12958862 0.85 LMNA (0.43) LMNANT5EIDO1DPP4MEN1
SCHEMBL27095783 0.83 TAAR1 (0.56) IDO1DPP4MEN1KMT2AKDM4E
SCHEMBL11293557 0.82 LMNA (0.47) LMNANT5EIDO1DPP4MEN1
SCHEMBL30414816 0.82 NT5E (0.46) NT5EIDO1DPP4MEN1KMT2A
SCHEMBL4786965 0.82 NT5E (0.46) NT5EIDO1DPP4MEN1KMT2A
SCHEMBL1809226 0.81 PDGFRB (0.48) NT5EMEN1KMT2AALDH1A1PDGFRB
SCHEMBL12958861 0.79 DPP4 (0.48) DPP4MEN1KMT2AKDM4EMAPT
SCHEMBL12958859 0.79 TRPM8 (0.42) LMNANT5EMEN1KMT2AKDM4E
SCHEMBL1810399 0.79 DPP4 (0.48) NT5EDPP4MEN1KMT2AKDM4E
SCHEMBL24961152 0.78 MEN1 (0.50) LMNANT5EDPP4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309557-B2 Pyrimidin-4-ylpropanedinitrile derivatives, processes for their preparation and their use as herbicides and plant growth regulators BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-11-13 US disclosed
CN-101646657-B Process for producing trichloropyrimidine compound SUMITOMO CHEMICAL CO JP 2012-08-08 CN disclosed
US-8158787-B2 Process for producing trichloropyrimidine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2408305-A1 PYRIMINDINE-4-YLPROPANE DINITRILE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE AND PLANT GROWTH REGULATORS Bayer CropScience AG (DE) 2012-01-25 EP disclosed
WO-2010108611-A1 PYRIMINDINE-4-YLPROPANE DINITRILE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2010-09-30 WO disclosed
US-20100240536-A1 PYRIMIDIN-4-YLPROPANEDINITRILE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2010-09-23 US disclosed
EP-2229813-A1 Pyrimidine-4-ylpropandinitrile derivatives, method for their manufacture and their use as herbicides and plant growth regulators Bayer CropScience AG (DE) 2010-09-22 EP disclosed
US-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2128141-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND Sumitomo Chemical Company, Limited (JP) 2009-12-02 EP 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 (2 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-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND DPYD, TYMP, TST LMNA 4884/4885NT5E 3328/4885IDO1 3575/4885
US-20100240536-A1 PYRIMIDIN-4-YLPROPANEDINITRILE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS DDT, PLPBP, HPD LMNA 3510/4885NT5E 2471/4885IDO1 91/4885

“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.