SCHEMBL1609704

SCHEMBL1609704

COC(=O)c1nc(C2CC2)nc(NCc2ccccc2)c1Cl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.62
PDE4B Q07343 3/20 0.52
PDE4D Q08499 3/20 0.52
CHRM3 P20309 1/20 0.52
PDE4A P27815 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE5A O76074 1/20 0.47
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
F2 P00734 2/20 0.41
PLAU P00749 2/20 0.41
PPARG P37231 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 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
SCHEMBL1609147 0.91 PDE10A (0.50) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609839 0.91 PDE10A (0.52) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609772 0.90 PDE10A (0.61) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609451 0.90 PDE10A (0.52) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609768 0.90 PDE10A (0.49) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609755 0.90 PDE10A (0.63) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL12712720 0.89 PDE10A (0.49) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609426 0.89 PDE10A (0.48) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609715 0.89 PDE10A (0.48) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609831 0.89 PDE10A (0.48) PDE10APDE4BPDE4DCHRM3PDE4A

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 6 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
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
EP-2237669-A2 CHEMICAL COMPOUNDS Syngenta Limited (GB) 2010-10-13 EP disclosed
WO-2009081112-A2 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-07-02 WO 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 1704/4885PDE4B 1132/4885PDE4D 2126/4885

“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.