SCHEMBL13664217

SCHEMBL13664217

Cc1ccccc1C(=O)c1nn(-c2ccc(Cl)cc2)c(N)c1C#N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
GAA P10253 3/20 0.49
POLB P06746 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
KDM4E B2RXH2 3/20 0.42
HTT P42858 2/20 0.41
CNR1 P21554 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 1/20 0.39
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 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
SCHEMBL13667900 0.85 POLB (0.44) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664232 0.84 MAPT (0.48) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664174 0.84 MAPT (0.52) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664161 0.82 MAPT (0.51) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664226 0.81 MAPT (0.48) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664231 0.81 MAPT (0.47) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664246 0.80 MAPT (0.48) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664223 0.79 MAPT (0.52) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664212 0.79 MAPT (0.48) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664221 0.78 MAPT (0.47) MAPTGAAPOLBTDP1L3MBTL1

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 4701/4885GAA 2005/4885POLB 4851/4885

“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.