SCHEMBL1850607

SCHEMBL1850607

CCOC(=O)c1cccc(-c2cccc3nn(Cc4cccc(OC)c4)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 1/20 0.52
ALDH1A1 P00352 4/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KMT2A Q03164 2/20 0.45
ELANE P08246 2/20 0.43
KLKB1 P03952 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 3/20 0.42
TP53 P04637 2/20 0.42
HPGD P15428 3/20 0.42
GPR55 Q9Y2T6 1/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42
PTGER4 P35408 1/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 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
SCHEMBL1856096 0.89 GPR52 (0.54) GPR52ALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL1853272 0.89 GPR52 (0.53) GPR52ALDH1A1KMT2AMAPTGPR55
SCHEMBL1852588 0.88 GPR52 (0.53) GPR52ALDH1A1KMT2AELANEKLKB1
SCHEMBL3215484 0.88 GPR52 (0.55) GPR52ALDH1A1NPSR1ELANEKLKB1
SCHEMBL1850671 0.87 GPR52 (0.62) GPR52ALDH1A1KMT2AKLKB1TP53
SCHEMBL1851680 0.87 GPR52 (0.51) GPR52ALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL1851194 0.86 GPR52 (0.70) GPR52ALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL1849196 0.85 GPR52 (0.52) GPR52ALDH1A1KLKB1SMN1; SMN2HPGD
SCHEMBL1849364 0.85 GPR52 (0.51) GPR52ALDH1A1NPSR1ELANESMN1; SMN2
SCHEMBL1854994 0.85 GPR52 (0.52) GPR52ALDH1A1NPSR1ELANEKLKB1

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 1/4885ALDH1A1 2005/4885NPSR1 106/4885

“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.