SCHEMBL3211066

SCHEMBL3211066

N#CCCNC(=O)c1cccc(-c2cccc3sc(Cc4cccc(C(F)(F)F)c4)cc23)c1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 15/20 0.81
SNCA P37840 1/20 0.43
SCD O00767 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
SLC9A1 P19634 1/20 0.42

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
SCHEMBL1850174 0.89 GPR52 (1.00) GPR52
SCHEMBL1851150 0.87 GPR52 (0.81) GPR52
SCHEMBL1849853 0.87 GPR52 (0.82) GPR52SCD
SCHEMBL3204361 0.86 GPR52 (0.59) GPR52SNCASCD
SCHEMBL3219486 0.85 GPR52 (0.79) GPR52SNCASCDSLC9A1
SCHEMBL1856133 0.84 GPR52 (0.81) GPR52SNCAALDH1A1POLB
SCHEMBL3208649 0.84 GPR52 (0.57) GPR52SNCASCDSLC9A1
SCHEMBL3209814 0.82 GPR52 (0.57) GPR52SNCAALDH1A1POLB
SCHEMBL1852770 0.82 GPR52 (0.74) GPR52ALDH1A1SLC9A1
SCHEMBL1850088 0.82 GPR52 (0.59) GPR52SNCASLC9A1

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 1/4885SNCA 2055/4885SCD 3465/4885

“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.