SCHEMBL3448249

SCHEMBL3448249

Nc1ncc(-c2cnc(Nc3ccc(F)c(Cl)c3)nc2-n2nccn2)cn1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.53
STK17A Q9UEE5 5/20 0.48
STK17B O94768 3/20 0.48
CSNK1A1 P48729 1/20 0.40
TDO2 P48775 3/20 0.40
BRAF P15056 1/20 0.40
APP P05067 1/20 0.40
AXL P30530 2/20 0.39
ULK1 O75385 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
EGFR P00533 1/20 0.39
KDR P35968 1/20 0.39
GRM1 Q13255 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
SCHEMBL3448245 0.89 MAPK1 (0.47) MAPK1STK17ASTK17BTDO2APP
SCHEMBL3449350 0.85 MAPK1 (0.53) MAPK1STK17ASTK17BCSNK1A1TDO2
SCHEMBL3450305 0.83 MAPK1 (0.48) MAPK1STK17ASTK17BCSNK1A1TDO2
SCHEMBL3451057 0.83 MAPK1 (0.46) MAPK1STK17ASTK17BCSNK1A1TDO2
SCHEMBL3448297 0.82 MAPK1 (0.50) MAPK1STK17ASTK17BCSNK1A1TDO2
SCHEMBL3450597 0.82 TDO2 (0.52) MAPK1STK17ASTK17BTDO2
SCHEMBL3450701 0.82 KCNN3 (0.51) MAPK1STK17ASTK17BCSNK1A1TDO2
SCHEMBL3449010 0.81 CSNK2A1 (0.45) MAPK1STK17ASTK17BEGFR
SCHEMBL3449066 0.79 MAPK1 (0.47) MAPK1STK17ASTK17BCSNK1A1TDO2
SCHEMBL3449322 0.79 MAPK1 (0.47) MAPK1STK17ASTK17BCSNK1A1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 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 (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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD MAPK1 2905/4885STK17A 1984/4885STK17B 2457/4885

“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.