SCHEMBL13664214

SCHEMBL13664214

N#Cc1c(C(=O)c2ccc(C(F)(F)F)cc2)nn(-c2ccc(Cl)cc2Br)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 1/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
GABRP O00591 2/20 0.37
GABRD O14764 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB1 P18505 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
GABRB2 P47870 2/20 0.37
GABRA4 P48169 2/20 0.37
GABRE P78334 2/20 0.37
GABRA6 Q16445 2/20 0.37
GABRG1 Q8N1C3 2/20 0.37
GABRG3 Q99928 2/20 0.37
GABRQ Q9UN88 2/20 0.37
LMNA P02545 2/20 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
SCHEMBL13664218 0.89 CNR1 (0.45) MAPTKDM4ESMN1; SMN2NPSR1CNR1
SCHEMBL13664198 0.89 GABRP (0.41) MARS1MAPTKDM4EGABRPGABRD
SCHEMBL13664171 0.84 MAPT (0.47) MAPTKDM4EGABRPGABRDGABRA1
SCHEMBL13664205 0.80 CA1 (0.44) MAPTKDM4ELMNASMN1; SMN2HTT
SCHEMBL13664184 0.77 CNR1 (0.40) MAPTKDM4ELMNASMN1; SMN2NPSR1
SCHEMBL13664204 0.77 MAPT (0.43) MAPTKDM4EGABRPGABRDGABRA1
SCHEMBL13664195 0.77 KDM4E (0.50) MAPTKDM4ELMNACNR1KMT2A
SCHEMBL13664191 0.77 MAPK14 (0.48) MAPTKDM4ELMNASMN1; SMN2NPSR1
SCHEMBL13664193 0.76 MAPT (0.47) MAPTKDM4EGABRPGABRDGABRA1
SCHEMBL13664190 0.76 MAPT (0.47) MAPTKDM4EGABRPGABRDGABRA1

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 MARS1 3699/4885MAPT 4701/4885KDM4E 3380/4885

“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.