SCHEMBL1849196

SCHEMBL1849196

CCOC(=O)c1cccc(-c2cccc3nn(Cc4ccc(F)c(F)c4)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 1/20 0.52
GRM2 Q14416 2/20 0.42
JMJD6 Q6NYC1 2/20 0.41
KLKB1 P03952 1/20 0.40
PRKDC P78527 1/20 0.39
S1PR3 Q99500 1/20 0.39
AGTR1 P30556 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL3217768 0.92 GPR52 (0.50) GPR52GRM2JMJD6KLKB1PRKDC
SCHEMBL1849364 0.91 GPR52 (0.51) GPR52GRM2JMJD6PRKDCAGTR1
SCHEMBL3215484 0.90 GPR52 (0.55) GPR52GRM2JMJD6KLKB1S1PR3
SCHEMBL1851300 0.89 GPR52 (0.47) GPR52GRM2JMJD6KLKB1PRKDC
SCHEMBL1852588 0.88 GPR52 (0.53) GPR52JMJD6KLKB1HPGDSMN1; SMN2
SCHEMBL1856096 0.88 GPR52 (0.54) GPR52JMJD6SMN1; SMN2ALDH1A1
SCHEMBL1857340 0.87 GPR52 (0.46) GPR52GRM2JMJD6KLKB1PRKDC
SCHEMBL1854994 0.86 GPR52 (0.52) GPR52GRM2JMJD6KLKB1S1PR3
SCHEMBL1853574 0.86 GPR52 (0.48) GPR52GRM2JMJD6KLKB1PRKDC
SCHEMBL1852543 0.86 GPR52 (0.54) GPR52SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 GPR52 1/4885GRM2 232/4885JMJD6 3726/4885

“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.