SCHEMBL961007

SCHEMBL961007

N#CCCNC(=O)c1cccc(-c2cccc(Oc3cccc(Cl)c3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 2/20 0.47
GRM5 P41594 5/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
SNCA P37840 3/20 0.42
PRKD1 Q15139 1/20 0.42
LOXL2 Q9Y4K0 3/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
FYN P06241 1/20 0.40
LOX P28300 1/20 0.40

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
SCHEMBL964557 0.93 GPR52 (0.50) GPR52GRM5L3MBTL1SNCAPRKD1
SCHEMBL962211 0.91 GPR52 (0.48) GPR52GRM5L3MBTL1SNCAPRKD1
SCHEMBL963876 0.90 GPR52 (0.45) GPR52GRM5PRKD1NR1H2NR1H3
SCHEMBL960449 0.89 PRKD1 (0.45) GPR52GRM5L3MBTL1PRKD1LOXL2
SCHEMBL961353 0.88 MAPT (0.48) SNCAPRKD1LOXL2FYNLOX
SCHEMBL963502 0.87 GPR52 (0.46) GPR52SNCAPRKD1NR1H2NR1H3
SCHEMBL12918976 0.86 GPR52 (0.56) GPR52L3MBTL1LOXL2LOX
SCHEMBL958148 0.86 FYN (0.42) GPR52GRM5L3MBTL1PRKD1LOXL2
SCHEMBL959544 0.84 GPR52 (0.45) GPR52PRKD1NR1H2NR1H3
SCHEMBL958003 0.83 PPARG (0.45) GPR52L3MBTL1PRKD1LOXL2FYN

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
US-20110009421-A1 COMPOUND HAVING 6-MEMBERED AROMATIC RING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20110009421-A1 COMPOUND HAVING 6-MEMBERED AROMATIC RING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20110009421-A1 COMPOUND HAVING 6-MEMBERED AROMATIC RING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
EP-2253618-A1 COMPOUND HAVING 6-MEMBERED AROMATIC RING Takeda Pharmaceutical Company Limited (JP) 2010-11-24 EP disclosed
EP-2253618-A1 COMPOUND HAVING 6-MEMBERED AROMATIC RING Takeda Pharmaceutical Company Limited (JP) 2010-11-24 EP 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-20110009421-A1 COMPOUND HAVING 6-MEMBERED AROMATIC RING GPR4, NR3C2, NR5A2 GPR52 23/4885GRM5 72/4885L3MBTL1 4361/4885

“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.