SCHEMBL379882

SCHEMBL379882

CNC(=O)c1ccc(C)c(-c2ccn3c(-c4ccccc4Cl)nnc3c2)c1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 12/20 0.78
MAPK14 Q16539 4/20 0.54
RAF1 P04049 1/20 0.50
ESR2 Q92731 1/20 0.49
MAPK11 Q15759 1/20 0.44
PLA2G7 Q13093 1/20 0.41
RIPK2 O43353 1/20 0.41
PDE2A O00408 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
SCHEMBL380112 0.91 MAPK13 (0.76) MAPK13MAPK14RAF1ESR2PLA2G7
SCHEMBL379821 0.89 MAPK13 (0.74) MAPK13MAPK14RAF1PDE2A
SCHEMBL380253 0.89 MAPK13 (0.74) MAPK13MAPK14RAF1ESR2PLA2G7
SCHEMBL379824 0.89 MAPK13 (0.75) MAPK13MAPK14RAF1PLA2G7
SCHEMBL379963 0.88 MAPK13 (0.71) MAPK13MAPK14RAF1MAPK11PLA2G7
SCHEMBL380034 0.88 MAPK13 (1.00) MAPK13MAPK14RAF1
SCHEMBL380661 0.87 MAPK13 (0.73) MAPK13MAPK14RAF1
SCHEMBL379548 0.84 MAPK13 (0.67) MAPK13MAPK14RAF1ESR2PLA2G7
SCHEMBL379819 0.84 MAPK13 (0.67) MAPK13MAPK14RAF1PDE2A
SCHEMBL3277409 0.81 MAPK13 (0.52) MAPK13MAPK14RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086973-B1 IMIDAZO- AND TRIAZOLO-PYRIDINE COMPOUNDS AND METHODS OF USE THEROF AMGEN INC (US) 2012-01-25 EP claimed
US-7700593-B2 Imidazo- and triazolo-pyridine compounds and methods of use thereof AMGEN INC. (US) 2010-04-20 US claimed
EP-2086973-A2 IMIDAZO- AND TRIAZOLO-PYRIDINE COMPOUNDS AND METHODS OF USE THEROF Amgen Inc., (US) 2009-08-12 EP claimed
US-20080161303-A1 Imidazo- and triazolo-pyridine compounds and methods of use thereof AMGEN INC. (US) 2008-07-03 US claimed
WO-2008045393-A2 IMIDAZO- AND TRIAZOLO-PYRIDINE COMPOUNDS AND METHODS OF USE THEROF AMGEN INC. (US) 2008-04-17 WO claimed
EP-2086973-B1 IMIDAZO- AND TRIAZOLO-PYRIDINE COMPOUNDS AND METHODS OF USE THEROF AMGEN INC (US) 2012-01-25 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 (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-20080161303-A1 Imidazo- and triazolo-pyridine compounds and methods of use thereof MAPK1, MAP3K1, MAP3K7 MAPK13 37/4885MAPK14 39/4885RAF1 42/4885

“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.