SCHEMBL2034739

SCHEMBL2034739

CNC(=O)c1cccc(-c2ccn3nc(-c4ccc(F)c(F)c4)cc3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.44
NR4A2 P43354 1/20 0.44
PDK2 Q15119 1/20 0.42
GRM5 P41594 1/20 0.42
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
FYN P06241 4/20 0.41
TDP2 O95551 3/20 0.40
CDK8 P49336 1/20 0.40
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
CRBN Q96SW2 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA1A P35348 1/20 0.39
MET P08581 1/20 0.38
FAAH O00519 2/20 0.38
MAP4K4 O95819 1/20 0.38

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
SCHEMBL2029037 0.90 TDP2 (0.45) PIK3CGNR4A2PDK2GRM5KDM5A
SCHEMBL12544353 0.90 KDM5A (0.44) PIK3CGNR4A2PDK2GRM5KDM5A
SCHEMBL2009206 0.89 GRM5 (0.46) PIK3CGNR4A2PDK2GRM5KDM5A
SCHEMBL2032150 0.88 NR4A2 (0.58) PIK3CGNR4A2GRM5KDM5AKDM4C
SCHEMBL2034297 0.88 KDM5A (0.44) PIK3CGNR4A2PDK2GRM5KDM5A
SCHEMBL2034154 0.87 NR4A2 (0.48) PIK3CGNR4A2PDK2GRM5KDM5A
SCHEMBL2034283 0.86 PDK2 (0.46) PIK3CGNR4A2PDK2KDM5AKDM4C
SCHEMBL15135308 0.86 PIK3CG (0.45) PIK3CGNR4A2PDK2GRM5KDM5A
SCHEMBL2010291 0.85 PDK2 (0.43) PIK3CGNR4A2PDK2KDM5AKDM4C
SCHEMBL2054018 0.85 PDK2 (0.45) PIK3CGNR4A2PDK2GRM5KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507238-B1 DIPHENYL-PYRAZOLOPYRIDINE COMPOUNDS, THEIR PREPARATION AND THEIR APPLICATION AS MODULATORS OF THE NUCLEAR RECEPTOR NOT SANOFI SA (FR) 2013-07-31 EP claimed
US-20120245164-A1 DIPHENYL-PYRAZOLOPYRIDINE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF AS NUCLEAR RECEPTOR NOT MODULATORS SANOFI (FR) 2012-09-27 US claimed
EP-2507238-B1 DIPHENYL-PYRAZOLOPYRIDINE COMPOUNDS, THEIR PREPARATION AND THEIR APPLICATION AS MODULATORS OF THE NUCLEAR RECEPTOR NOT SANOFI SA (FR) 2013-07-31 EP disclosed
EP-2507238-A1 DIPHENYL-PYRAZOLOPYRDINE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF AS NUCLEAR RECEPTOR NOT MODULATORS SANOFI (FR) 2012-10-10 EP disclosed
WO-2011067544-A1 DIPHENYL-PYRAZOLOPYRDINE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF AS NUCLEAR RECEPTOR NOT MODULATORS SANOFI-AVENTIS (FR) 2011-06-09 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-20120245164-A1 DIPHENYL-PYRAZOLOPYRIDINE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF AS NUCLEAR RECEPTOR NOT MODULATORS NR4A3, NCOR1, NR4A2 PIK3CG 4644/4885NR4A2 3/4885PDK2 1996/4885

“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.