SCHEMBL13664175

SCHEMBL13664175

N#Cc1ccc(C(=O)c2nn(-c3ccc(F)cc3)c(N)c2C#N)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.63
MAPT P10636 2/20 0.51
BRAF P15056 1/20 0.48
KDR P35968 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
VNN1 O95497 1/20 0.41
ALOX12 P18054 1/20 0.41
KDM4E B2RXH2 2/20 0.41
KDM1A O60341 1/20 0.40
AR P10275 1/20 0.40
TP53 P04637 1/20 0.40
NR3C2 P08235 3/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CCNA1 P78396 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL13664162 0.89 MEN1 (0.51) MAPK14MAPTBRAFKDRMEN1
SCHEMBL13664196 0.89 MAPK14 (0.50) MAPK14MAPTBRAFKDRMEN1
SCHEMBL13664179 0.89 MAPT (0.50) MAPK14MAPTBRAFKDRMEN1
SCHEMBL13664177 0.89 MAPT (0.50) MAPK14MAPTBRAFKDRMEN1
SCHEMBL13664182 0.88 MAPT (0.51) MAPK14MAPTMEN1KMT2AGAA
SCHEMBL13664163 0.88 MAPT (0.51) MAPK14MAPTMEN1KMT2AGAA
SCHEMBL13664191 0.87 MAPK14 (0.48) MAPK14MAPTBRAFKDRMEN1
SCHEMBL13664180 0.86 KMT2A (0.51) MAPK14MAPTKMT2AALDH1A1VNN1
SCHEMBL13664173 0.83 MAPT (0.55) MAPK14MAPTMEN1KMT2AGAA
SCHEMBL13664209 0.82 MAPT (0.58) MAPK14MAPTBRAFKDRMEN1

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 4701/4885BRAF 4652/4885

“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.