SCHEMBL1850998

SCHEMBL1850998

Cc1c(Cc2cccc(C(F)(F)F)c2)sc2c(-c3cc(F)cc(C(=O)O)c3)cccc12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 10/20 0.44
PTGER4 P35408 4/20 0.40
PTGER1 P34995 1/20 0.40
PTGER2 P43116 1/20 0.40
NR4A2 P43354 2/20 0.39
PPARA Q07869 1/20 0.38

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
SCHEMBL1852456 0.96 GPR52 (0.46) GPR52PTGER4PTGER1PTGER2
SCHEMBL1854278 0.94 GPR52 (0.40) GPR52PTGER4PTGER1PTGER2NR4A2
SCHEMBL3198309 0.93 GPR52 (0.48) GPR52
SCHEMBL1857872 0.91 GPR52 (0.57) GPR52PTGER4PTGER2
SCHEMBL3208278 0.90 GPR52 (0.42) GPR52
SCHEMBL1850602 0.90 GPR52 (0.49) GPR52PTGER4PTGER2NR4A2
SCHEMBL1852457 0.88 GPR52 (0.44) GPR52
SCHEMBL3212271 0.87 GPR52 (0.57) GPR52
SCHEMBL3198491 0.86 GPR52 (0.60) GPR52
SCHEMBL1852132 0.86 GPR52 (0.59) 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
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 888/4885PTGER1 931/4885

“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.