SCHEMBL13664172

SCHEMBL13664172

Cc1ccc(C(=O)c2nn(-c3ccccc3)c(N)c2C#N)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
ALDH1A1 P00352 5/20 0.64
LMNA P02545 4/20 0.64
HPGD P15428 4/20 0.64
KDM4E B2RXH2 4/20 0.51
GAA P10253 1/20 0.51
POLB P06746 1/20 0.45
RIPK1 Q13546 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
CYP2C9 P11712 2/20 0.44
CYP1A2 P05177 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL13664173 0.94 MAPT (0.55) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664192 0.93 ALDH1A1 (0.56) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664163 0.89 MAPT (0.51) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664161 0.88 MAPT (0.51) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664170 0.88 MAPT (0.50) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664203 0.88 MAPT (0.50) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664162 0.88 MEN1 (0.51) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664167 0.88 MAPT (0.50) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664178 0.87 KMT2A (0.51) MAPTALDH1A1LMNAHPGDKDM4E
SCHEMBL13664165 0.87 KMT2A (0.51) MAPTALDH1A1LMNAHPGDKDM4E

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-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 MAPT 4701/4885ALDH1A1 3415/4885LMNA 4188/4885

“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.