SCHEMBL13664331

SCHEMBL13664331

Cc1ccc(C(=O)c2nn(-c3ccc(Cl)cc3)c(NCCCNC(=O)c3cccnc3)c2C#N)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CFTR P13569 2/20 0.45
KMT2A Q03164 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 2/20 0.43
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.40
NAMPT P43490 2/20 0.40

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
SCHEMBL13664329 0.91 CNR1 (0.46) KMT2ATDP1MEN1MAPTSMN1; SMN2
SCHEMBL13664373 0.91 POLB (0.46) KMT2ATDP1MEN1MAPTPOLB
SCHEMBL13664143 0.91 POLB (0.46) KMT2ATDP1MEN1MAPTPOLB
SCHEMBL13664332 0.90 L3MBTL1 (0.43) CFTRKMT2ATDP1MEN1MAPT
SCHEMBL13664349 0.90 CNR1 (0.46) KMT2ATDP1MEN1MAPTSMN1; SMN2
SCHEMBL13664403 0.89 L3MBTL1 (0.46) KMT2ATDP1MEN1MAPTPOLB
SCHEMBL13664372 0.89 CNR1 (0.47) CFTRTDP1MAPTPOLBGAA
SCHEMBL13664347 0.89 CNR1 (0.43) CFTRKMT2ATDP1MEN1MAPT
SCHEMBL13664334 0.88 KDM4E (0.49) KMT2ATDP1MEN1MAPTSMN1; SMN2
SCHEMBL13664333 0.88 MAPT (0.42) KMT2ATDP1MEN1MAPTPOLB

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 CFTR 1209/4885KMT2A 3722/4885TDP1 4748/4885

“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.