SCHEMBL1610344

SCHEMBL1610344

COC(=O)c1nc(C2CC2)nc(NCCNc2ccccc2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 10/20 0.44
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 2/20 0.39
TSHR P16473 1/20 0.39
EPHX1 P07099 1/20 0.36
CHRM3 P20309 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
LMNA P02545 2/20 0.36
PPARG P37231 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NR2E3 Q9Y5X4 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL1609426 0.88 PDE10A (0.48) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1610098 0.86 PDE5A (0.44) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1608985 0.86 PDE10A (0.47) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1609704 0.85 PDE10A (0.62) PDE10AALDH1A1CHRM3PDE4APDE4B
SCHEMBL1610108 0.85 PDE10A (0.46) PDE10AALDH1A1EPHX1CHRM3PDE4A
SCHEMBL1610314 0.84 PDE10A (0.44) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1609949 0.84 CA12 (0.45) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1610306 0.83 PLAU (0.47) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1610415 0.83 PDE10A (0.43) PDE10AALDH1A1SMN1; SMN2HSD17B10MAPK1
SCHEMBL1608939 0.82 ALDH1A1 (0.44) PDE10AALDH1A1SMN1; SMN2LMNATDP1

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 3 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
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 1704/4885ALDH1A1 1562/4885SMN1; SMN2 2654/4885

“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.