SCHEMBL1850436

SCHEMBL1850436

O=C(NC1CC1)c1cccc(-c2cccc3oc(Cc4cccc(C(F)(F)F)c4)cc23)c1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 12/20 0.76
POLB P06746 1/20 0.47
MRGPRX4 Q96LA9 3/20 0.45
DRD4 P21917 1/20 0.45
CRHR1 P34998 1/20 0.44
SMYD3 Q9H7B4 1/20 0.43
CCR2 P41597 1/20 0.43

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
SCHEMBL3211510 0.95 GPR52 (0.72) GPR52POLBMRGPRX4DRD4CCR2
SCHEMBL1848117 0.88 GPR52 (0.66) GPR52
SCHEMBL1847900 0.87 GPR52 (0.75) GPR52MRGPRX4
SCHEMBL1850015 0.86 GPR52 (1.00) GPR52MRGPRX4
SCHEMBL13489547 0.86 GPR52 (0.85) GPR52POLBMRGPRX4
SCHEMBL1853632 0.86 GPR52 (0.85) GPR52POLB
Hydrochloric Acid SCHEMBL3216086 0.85 GPR52 (0.84) GPR52POLBMRGPRX4
SCHEMBL1851459 0.85 GPR52 (0.80) GPR52POLB
SCHEMBL3219294 0.84 GPR52 (0.82) GPR52POLB
SCHEMBL3210306 0.84 GPR52 (0.82) GPR52POLB

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 5 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
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 1/4885POLB 4067/4885MRGPRX4 287/4885

“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.