SCHEMBL1853172

SCHEMBL1853172

O=C(O)c1ccc(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)sc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 14/20 0.67
S1PR5 Q9H228 3/20 0.52
S1PR4 O95977 2/20 0.52
NR4A2 P43354 1/20 0.48
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
PTGER4 P35408 1/20 0.46
PTGER2 P43116 1/20 0.46

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
SCHEMBL1863284 0.92 GPR52 (0.59) GPR52S1PR5S1PR4NR4A2MEN1
SCHEMBL3200888 0.91 GPR52 (0.68) GPR52S1PR5S1PR4
SCHEMBL1853402 0.91 GPR52 (0.75) GPR52S1PR5S1PR4NR4A2
SCHEMBL1849113 0.88 GPR52 (0.63) GPR52S1PR5S1PR4
SCHEMBL1854179 0.87 GPR52 (0.62) GPR52S1PR5S1PR4MEN1ALDH1A1
SCHEMBL1848356 0.87 GPR52 (0.62) GPR52S1PR5S1PR4
SCHEMBL3221421 0.87 GPR52 (0.57) GPR52S1PR5S1PR4NR4A2PTGER4
SCHEMBL3196520 0.86 GPR52 (0.86) GPR52S1PR5S1PR4
SCHEMBL1849743 0.86 GPR52 (0.61) GPR52S1PR5S1PR4
SCHEMBL3198653 0.86 GPR52 (0.56) GPR52S1PR5S1PR4PTGER4PTGER2

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 696/4885S1PR4 565/4885

“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.