SCHEMBL13664196

SCHEMBL13664196

N#Cc1c(C(=O)c2ccc(Br)cc2)nn(-c2ccc(F)cc2)c1N

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
GAA P10253 1/20 0.46
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
ALOX12 P18054 1/20 0.41
KDM4E B2RXH2 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA4 P22748 2/20 0.40
CA9 Q16790 2/20 0.40
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
BRAF P15056 1/20 0.38
KDR P35968 1/20 0.38
XDH P47989 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL13664175 0.89 MAPK14 (0.63) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664177 0.88 MAPT (0.50) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664179 0.88 MAPT (0.50) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664162 0.88 MEN1 (0.51) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664203 0.88 MAPT (0.50) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664170 0.88 MAPT (0.50) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664168 0.88 MAPT (0.50) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664205 0.88 CA1 (0.44) MAPK14MAPTKMT2AMEN1ALDH1A1
SCHEMBL13664191 0.86 MAPK14 (0.48) MAPK14MAPTKMT2AMEN1GAA
SCHEMBL13664173 0.82 MAPT (0.55) MAPK14MAPTKMT2AMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-10-08 US disclosed
US-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-10-08 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-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists GIPR, GPR119, GLP1R MAPK14 1531/4885MAPT 4701/4885KMT2A 3722/4885

“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.