SCHEMBL1852273

SCHEMBL1852273

Cc1c2cccc(-c3cccc(C(=O)O)c3)c2nn1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 3/20 0.49
PTGER4 P35408 4/20 0.49
KDM4C Q9H3R0 1/20 0.48
P2RY14 Q15391 1/20 0.47
POLB P06746 1/20 0.43
NR4A2 P43354 1/20 0.43
PTGDR2 Q9Y5Y4 3/20 0.43
CNR2 P34972 1/20 0.42
PPARG P37231 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41

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
SCHEMBL1854858 0.94 MAPT (0.46) GPR52PTGER4KDM4CP2RY14POLB
SCHEMBL1849663 0.90 MAPT (0.48) GPR52PTGER4P2RY14POLB
SCHEMBL1849429 0.88 GPR52 (0.53) GPR52PTGER4KDM4CP2RY14PPARG
SCHEMBL1850028 0.87 GPR52 (0.68) GPR52PTGER4POLBCNR2PPARG
SCHEMBL3206733 0.84 GPR52 (0.56) GPR52PTGER4P2RY14POLBPPARG
SCHEMBL1849430 0.83 GPR52 (0.42) GPR52PTGER4P2RY14POLBPTGDR2
SCHEMBL1854751 0.78 GPR52 (0.75) GPR52PTGER4KDM4CPOLBNR4A2
SCHEMBL3221864 0.77 GPR52 (0.75) GPR52PTGER4KDM4CPOLBNR4A2
SCHEMBL3209116 0.76 KDM4C (0.46) GPR52PTGER4KDM4CP2RY14POLB
SCHEMBL1851234 0.76 GPR52 (0.66) GPR52KDM4CP2RY14NR4A2CNR2

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 1/4885PTGER4 888/4885KDM4C 2640/4885

“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.