SCHEMBL1665870

SCHEMBL1665870

COc1cnccc1-c1nc2cc(C(F)(F)F)ccc2s1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ILK Q13418 2/20 0.53
AGPAT2 O15120 1/20 0.49
DYRK1A Q13627 8/20 0.47
NCS1 P62166 1/20 0.46
CYP1A2 P05177 1/20 0.46
METAP2 P50579 1/20 0.46
GPBAR1 Q8TDU6 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
HCRTR1 O43613 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
AHR P35869 1/20 0.42

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
SCHEMBL1665437 0.88 ILK (0.53) ILKAGPAT2DYRK1ANCS1
SCHEMBL1665867 0.83 CYP1A2 (0.46) DYRK1ACYP1A2METAP2GPBAR1
SCHEMBL1665863 0.83 ILK (0.57) ILKAGPAT2DYRK1ACYP1A2METAP2
SCHEMBL11953191 0.83 DYRK1A (0.50) DYRK1AKDM4EMEN1HCRTR1ALDH1A1
SCHEMBL15455680 0.82 ILK (0.51) ILKAGPAT2DYRK1ANCS1KDM4E
SCHEMBL1666264 0.81 ILK (0.56) ILKAGPAT2DYRK1A
SCHEMBL1666257 0.81 ILK (0.53) ILKAGPAT2DYRK1ANCS1
SCHEMBL1665807 0.78 ILK (0.50) ILKAGPAT2DYRK1AMAPT
SCHEMBL11894802 0.77 ILK (0.49) ILKAGPAT2DYRK1A
SCHEMBL15455623 0.77 AHR (0.70) ILKAGPAT2DYRK1ANCS1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486035-B1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL CO (JP) 2015-08-26 EP disclosed
EP-2486035-B1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL CO (JP) 2015-08-26 EP disclosed
CN-102686585-B Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL CO.,LTD. (JP) 2014-10-08 CN disclosed
US-8742112-B2 Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-03 US disclosed
US-8742112-B2 Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-03 US disclosed
CN-102686585-A Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL CO 2012-09-19 CN disclosed
EP-2486035-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST Sumitomo Chemical Co., Ltd (JP) 2012-08-15 EP disclosed
US-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-02 US disclosed
US-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-02 US disclosed
WO-2011043404-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-14 WO disclosed
WO-2011043404-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-14 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-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST HAAO, DDT, ACHE ILK 4502/4885AGPAT2 1107/4885DYRK1A 4590/4885

“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.