SCHEMBL1609892

SCHEMBL1609892

Cc1ccc(CNc2nc(C3CC3)nc(C(=O)O)c2Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 13/20 0.54
PDE4B Q07343 3/20 0.47
PDE4D Q08499 3/20 0.47
CHRM3 P20309 1/20 0.47
PDE4A P27815 1/20 0.47
PDE4C Q08493 1/20 0.47
KMT2A Q03164 1/20 0.41
PDE5A O76074 1/20 0.40
CTNNB1 P35222 1/20 0.38
TCF7L2 Q9NQB0 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
SCHEMBL1611084 0.89 PDE10A (0.60) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609451 0.89 PDE10A (0.52) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609122 0.88 PDE10A (0.48) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL12713412 0.81 PDE10A (0.40) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1611392 0.81 PDE10A (0.44) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609883 0.81 PDE10A (0.43) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609704 0.81 PDE10A (0.62) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609147 0.81 PDE10A (0.50) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609772 0.80 PDE10A (0.61) PDE10APDE4BPDE4DCHRM3PDE4A
SCHEMBL1609768 0.80 PDE10A (0.49) 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 4 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
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.