SCHEMBL19813060

SCHEMBL19813060

Nc1ncc(-c2ccncc2)cc1-c1ccc(C(=O)NC(CO)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 15/20 1.00
GSK3B P49841 5/20 0.73
ROCK1 Q13464 5/20 0.73
CLK4 Q9HAZ1 5/20 0.73
ROCK2 O75116 5/20 0.73
RPS6KA5 O75582 4/20 0.73
AKT1 P31749 4/20 0.73
NEK4 P51957 4/20 0.73
PRKCD Q05655 4/20 0.73
PRKG2 Q13237 4/20 0.73
PRKG1 Q13976 4/20 0.73
PKN2 Q16513 4/20 0.73
GSK3A P49840 4/20 0.73
MAP4K4 O95819 3/20 0.73
RPS6KB1 P23443 3/20 0.73
AKT2 P31751 3/20 0.73
CDC42BPA Q5VT25 3/20 0.73
SGK2 Q9HBY8 3/20 0.73
PRKACA P17612 3/20 0.73
PRKX P51817 3/20 0.73

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
SCHEMBL16679393 1.00 MAPK1 (1.00) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL19813092 0.88 MAPK1 (1.00) MAPK1
SCHEMBL16679599 0.88 MAPK1 (1.00) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL16679276 0.88 MAPK1 (1.00) MAPK1
SCHEMBL19813035 0.88 MAPK1 (1.00) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL3111276 0.86 ROCK2 (1.00) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL3092517 0.86 ROCK2 (1.00) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL3655064 0.82 ROCK2 (0.92) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL20145745 0.82 MAPK1 (0.90) MAPK1GSK3BROCK1CLK4ROCK2
SCHEMBL19822285 0.80 MAPK1 (0.67) MAPK1MAP4K4CHEK2

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
US-10188649-B2 Aminoheteroaryl benzamides as kinase inhibitors NOVARTIS AG (CH) 2019-01-29 US disclosed
EP-3063143-B1 AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2018-05-16 EP disclosed
US-20180028532-A1 AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2018-02-01 US 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-10188649-B2 Aminoheteroaryl benzamides as kinase inhibitors ABL1, MAP3K12, MAP3K2 MAPK1 95/4885GSK3B 347/4885ROCK1 427/4885
US-20180028532-A1 AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS ABL1, MAP3K12, MAP3K2 MAPK1 95/4885GSK3B 347/4885ROCK1 427/4885

“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.