SCHEMBL13664203

SCHEMBL13664203

Cc1ccc(-n2nc(C(=O)c3ccc(Br)cc3)c(C#N)c2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
LMNA P02545 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.43
KMT2A Q03164 3/20 0.41
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
SMPD1 P17405 1/20 0.39
GAA P10253 3/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
MAPK14 Q16539 1/20 0.38
XDH P47989 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL13664170 1.00 MAPT (0.50) MAPTLMNAALDH1A1HPGDTSHR
SCHEMBL13664173 0.94 MAPT (0.55) MAPTLMNAALDH1A1HPGDKMT2A
SCHEMBL13664163 0.89 MAPT (0.51) MAPTLMNAALDH1A1HPGDKMT2A
SCHEMBL13664162 0.88 MEN1 (0.51) MAPTLMNAALDH1A1HPGDKMT2A
SCHEMBL13664161 0.88 MAPT (0.51) MAPTLMNAALDH1A1HPGDKMT2A
SCHEMBL13664168 0.88 MAPT (0.50) MAPTLMNAALDH1A1HPGDTSHR
SCHEMBL13664196 0.88 MAPK14 (0.50) MAPTLMNAALDH1A1HPGDTSHR
SCHEMBL13664172 0.88 MAPT (0.64) MAPTLMNAALDH1A1HPGDNPC1
SCHEMBL13664165 0.87 KMT2A (0.51) MAPTLMNAALDH1A1HPGDKMT2A
SCHEMBL13664178 0.87 KMT2A (0.51) MAPTLMNAALDH1A1HPGDKMT2A

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

“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.