SCHEMBL1849029

SCHEMBL1849029

O=C(O)c1cncc(-c2cccc3cc(Cc4cc(F)cc(Cl)c4)sc23)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 5/20 0.60
S1PR5 Q9H228 11/20 0.41
TBXA2R P21731 1/20 0.39
PTGER1 P34995 1/20 0.39
S1PR4 O95977 9/20 0.36
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
HCAR2 Q8TDS4 2/20 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
SCHEMBL1849572 0.88 GPR52 (0.71) GPR52S1PR5PTGER1S1PR4
SCHEMBL1849751 0.88 GPR52 (0.64) GPR52S1PR5PTGER1S1PR4
SCHEMBL1850515 0.88 GPR52 (0.59) GPR52
SCHEMBL1850860 0.87 GPR52 (0.68) GPR52
SCHEMBL3221305 0.86 GPR52 (0.62) GPR52S1PR5S1PR4
SCHEMBL1851292 0.82 GPR52 (0.56) GPR52S1PR5PTGER1S1PR4
SCHEMBL1855046 0.82 GPR52 (0.59) GPR52S1PR5S1PR4
SCHEMBL1850314 0.82 GPR52 (0.63) GPR52S1PR5S1PR4
SCHEMBL1847970 0.82 GPR52 (0.60) GPR52S1PR5S1PR4
SCHEMBL1850399 0.81 GPR52 (0.56) GPR52S1PR5

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 1/4885S1PR5 696/4885TBXA2R 281/4885

“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.