SCHEMBL1610899

SCHEMBL1610899

COC(=O)c1nc(C2CC2)nc(NCc2ccc(OC)cc2)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 7/20 0.48
RAB9A P51151 1/20 0.44
VNN1 O95497 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PDE2A O00408 1/20 0.41
PDE4B Q07343 2/20 0.40
PDE4D Q08499 2/20 0.40
CHRM3 P20309 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4C Q08493 1/20 0.40
MCHR1 Q99705 1/20 0.40
MAPT P10636 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL1609147 0.91 PDE10A (0.50) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609451 0.90 PDE10A (0.52) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609768 0.90 PDE10A (0.49) PDE10ARAB9APDE4BPDE4DCHRM3
SCHEMBL1610831 0.90 PDE10A (0.45) PDE10AVNN1
SCHEMBL1609715 0.89 PDE10A (0.48) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609831 0.89 PDE10A (0.48) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609704 0.89 PDE10A (0.62) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1613172 0.88 PDE10A (0.47) PDE10ARAB9APDE4BPDE4DCHRM3
SCHEMBL1609755 0.88 PDE10A (0.63) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1610706 0.87 PDE10A (0.47) PDE10ARAB9AL3MBTL1PDE4BPDE4D

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
WO-2009081112-A2 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-07-02 WO 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 PDE10A 1704/4885RAB9A 3012/4885VNN1 2057/4885

“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.