SCHEMBL13664386

SCHEMBL13664386

Cc1ccc(C(=O)c2nn(-c3ccc(Cl)cc3)c(NCCCNC(=O)c3cc4ncccn4n3)c2C#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DHODH Q02127 1/20 0.39
MALT1 Q9UDY8 8/20 0.39
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CFTR P13569 1/20 0.36
CNR2 P34972 2/20 0.35
KDM4E B2RXH2 2/20 0.35
CNR1 P21554 3/20 0.35
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34

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
SCHEMBL13664472 0.91 MALT1 (0.37) MEN1KMT2ADHODHMALT1POLB
SCHEMBL13664378 0.89 KDM4E (0.48) DHODHMALT1POLBGAAMAPT
SCHEMBL13664330 0.89 KMT2A (0.52) MEN1KMT2ADHODHMALT1POLB
SCHEMBL13664333 0.87 MAPT (0.42) MEN1KMT2ADHODHMALT1POLB
SCHEMBL13664393 0.86 LMNA (0.45) MEN1KMT2APOLBGAAMAPT
SCHEMBL13664143 0.85 POLB (0.46) MEN1KMT2AMALT1POLBGAA
SCHEMBL13664373 0.85 POLB (0.46) MEN1KMT2AMALT1POLBGAA
SCHEMBL13664334 0.84 KDM4E (0.49) MEN1KMT2APOLBGAAMAPT
SCHEMBL13664329 0.84 CNR1 (0.46) MEN1KMT2ADHODHPOLBGAA
SCHEMBL13664403 0.84 L3MBTL1 (0.46) MEN1KMT2AMALT1POLBGAA

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 MEN1 3462/4885KMT2A 3722/4885DHODH 4137/4885

“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.