SCHEMBL1609710

SCHEMBL1609710

COC(=O)c1nc(C2CC2)nc(NCc2ccc(C(F)(F)F)cc2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.47
PDE2A O00408 1/20 0.39
AURKA O14965 1/20 0.39
RPS6KB1 P23443 1/20 0.39
CNR1 P21554 2/20 0.38
PDE4B Q07343 2/20 0.38
PDE4D Q08499 2/20 0.38
CTNNB1 P35222 1/20 0.38
TCF7L2 Q9NQB0 1/20 0.38
CHRM3 P20309 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4C Q08493 1/20 0.38

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
SCHEMBL1609481 0.90 PDE10A (0.41) PDE10AAURKARPS6KB1
SCHEMBL1610831 0.89 PDE10A (0.45) PDE10ACTNNB1TCF7L2
SCHEMBL1609715 0.89 PDE10A (0.48) PDE10APDE4BPDE4DCTNNB1TCF7L2
SCHEMBL1609822 0.88 PDE10A (0.45) PDE10AAURKARPS6KB1CNR1
SCHEMBL1609147 0.88 PDE10A (0.50) PDE10ACNR1PDE4BPDE4DCHRM3
SCHEMBL1609768 0.87 PDE10A (0.49) PDE10ACNR1PDE4BPDE4DCHRM3
SCHEMBL1609755 0.87 PDE10A (0.63) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609451 0.87 PDE10A (0.52) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL12737919 0.87 PDE10A (0.50) PDE10ACNR1
SCHEMBL1609831 0.86 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 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
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 PDE10A 1704/4885PDE2A 1196/4885AURKA 1490/4885

“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.