SCHEMBL13664434

SCHEMBL13664434

Cc1ccc(C(=O)c2nn(-c3ccc(Cl)cc3)c(NCCCNC(=O)c3ccc(Cl)cc3Cl)c2C#N)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.44
CNR2 P34972 8/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 1/20 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
SCHEMBL13664371 0.92 POLB (0.42) CNR1CNR2POLBGAAMAPT
SCHEMBL13664143 0.91 POLB (0.46) CNR1CNR2POLBGAAMAPT
SCHEMBL13664373 0.91 POLB (0.46) CNR1CNR2POLBGAAMAPT
SCHEMBL13664408 0.90 POLB (0.42) CNR1POLBGAAMAPTTDP1
SCHEMBL13664403 0.89 L3MBTL1 (0.46) CNR1CNR2POLBGAAMAPT
SCHEMBL13664372 0.89 CNR1 (0.47) CNR1CNR2POLBGAAMAPT
SCHEMBL13664348 0.89 POLB (0.42) CNR1POLBGAAMAPTTDP1
SCHEMBL13664429 0.88 CFTR (0.43) POLBGAAMAPTTDP1L3MBTL1
SCHEMBL13664396 0.88 MAPT (0.41) CNR1POLBGAAMAPTTDP1
SCHEMBL13664404 0.88 CNR1 (0.46) CNR1CNR2POLBGAAMAPT

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 CNR1 367/4885CNR2 534/4885POLB 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.