SCHEMBL13664370

SCHEMBL13664370

Cc1ccc(C(=O)c2nn(-c3ccc(Cl)cc3)c(NCCCNC(=O)c3cc(C(C)C)on3)c2C#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
ATM Q13315 1/20 0.40
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MALT1 Q9UDY8 5/20 0.39
DHODH Q02127 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CNR2 P34972 2/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CNR1 P21554 2/20 0.36

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
SCHEMBL13664367 0.88 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1MAPTHTTLMNA
SCHEMBL13664391 0.88 POLB (0.42) SMN1; SMN2MAPTLMNAPOLBGAA
SCHEMBL13664143 0.87 POLB (0.46) MAPTLMNAPOLBGAATDP1
SCHEMBL13664373 0.87 POLB (0.46) MAPTLMNAPOLBGAATDP1
SCHEMBL13664325 0.87 GAA (0.41) ALDH1A1MAPTNPSR1LMNAPOLB
SCHEMBL13664403 0.86 L3MBTL1 (0.46) MAPTLMNAPOLBGAATDP1
SCHEMBL13664341 0.85 GAA (0.42) ALDH1A1MAPTNPSR1LMNAPOLB
SCHEMBL13664313 0.85 GAA (0.42) SMN1; SMN2ALDH1A1MAPTNPSR1LMNA
SCHEMBL13664389 0.85 DRD3 (0.42) MAPTPOLBGAATDP1L3MBTL1
SCHEMBL13664487 0.85 NPC1 (0.43) MAPTTSHRPOLBGAATDP1

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 1 patent. 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

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 SMN1; SMN2 3698/4885ALDH1A1 3415/4885MAPT 4701/4885

“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.