SCHEMBL3209129

SCHEMBL3209129

O=C(NCCO)c1cccc(-c2cccc3nn(Cc4cc(F)cc(Cl)c4)cc23)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 12/20 0.69
FYN P06241 5/20 0.42
ADORA3 P0DMS8 1/20 0.40
ADORA2B P29275 1/20 0.40
AURKA O14965 1/20 0.39

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
SCHEMBL1851055 0.97 GPR52 (0.65) GPR52FYNADORA3ADORA2B
SCHEMBL3217594 0.90 GPR52 (0.75) GPR52FYNADORA3ADORA2B
SCHEMBL3208468 0.90 GPR52 (0.57) GPR52ADORA3ADORA2BAURKA
SCHEMBL3207084 0.89 GPR52 (0.76) GPR52FYNADORA3ADORA2B
SCHEMBL1849152 0.89 GPR52 (0.79) GPR52FYN
SCHEMBL1851052 0.89 GPR52 (0.58) GPR52ADORA3ADORA2BAURKA
SCHEMBL1850562 0.88 GPR52 (0.72) GPR52FYNADORA3ADORA2B
SCHEMBL3206799 0.87 GPR52 (0.78) GPR52FYNADORA3ADORA2B
SCHEMBL1852548 0.87 GPR52 (0.70) GPR52FYNADORA3ADORA2B
SCHEMBL3207391 0.87 GPR52 (0.75) GPR52FYN

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
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US 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 1/4885FYN 1500/4885ADORA3 591/4885

“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.