SCHEMBL3206698

SCHEMBL3206698

NC(=O)c1cccc(-c2ccc(Cl)c3cc(Cc4cc(F)cc(Cl)c4)sc23)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 7/20 0.55
CLK1 P49759 1/20 0.40
METAP2 P50579 2/20 0.38
SHMT1 P34896 1/20 0.36
AURKA O14965 1/20 0.36
RPS6KB1 P23443 1/20 0.36
PARP1 P09874 3/20 0.35
PRKCI P41743 1/20 0.35
PRF1 P14222 1/20 0.35
FAAH O00519 1/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
DPP4 P27487 1/20 0.34

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
SCHEMBL1855888 0.96 GPR52 (0.52) GPR52CLK1METAP2SHMT1
SCHEMBL3217370 0.93 GPR52 (0.56) GPR52CLK1METAP2SHMT1AURKA
SCHEMBL1852756 0.91 GPR52 (0.56) GPR52
SCHEMBL7965937 0.90 GPR52 (0.51) GPR52CLK1AURKARPS6KB1
SCHEMBL1851933 0.90 GPR52 (0.53) GPR52CLK1METAP2SHMT1PARP1
SCHEMBL3204559 0.88 GPR52 (0.63) GPR52CLK1METAP2AURKA
SCHEMBL3219164 0.87 GPR52 (0.52) GPR52CLK1SHMT1PARP1PRF1
SCHEMBL1851960 0.86 GPR52 (0.55) GPR52NPC1RAB9A
SCHEMBL1855891 0.86 GPR52 (0.57) GPR52
SCHEMBL1849783 0.84 GPR52 (0.56) GPR52

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 1/4885CLK1 4628/4885METAP2 3832/4885

“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.