SCHEMBL1609426

SCHEMBL1609426

COC(=O)c1nc(C2CC2)nc(NCCc2ccccc2)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.48
PLAU P00749 2/20 0.43
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
CHRM3 P20309 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ACHE P22303 2/20 0.39
APP P05067 2/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.38
TSHR P16473 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
SCHEMBL1608985 0.94 PDE10A (0.47) PDE10APLAUALDH1A1SMN1; SMN2CHRM3
SCHEMBL1610108 0.93 PDE10A (0.46) PDE10AALDH1A1CHRM3PDE4APDE4B
SCHEMBL1609704 0.89 PDE10A (0.62) PDE10APLAUALDH1A1CHRM3PDE4A
SCHEMBL1610344 0.88 PDE10A (0.44) PDE10AALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL1610306 0.87 PLAU (0.47) PDE10APLAUALDH1A1SMN1; SMN2MAPT
SCHEMBL1611022 0.87 CA1 (0.50)
SCHEMBL1610415 0.86 PDE10A (0.43) PDE10APLAUALDH1A1SMN1; SMN2MAPT
SCHEMBL1608939 0.85 ALDH1A1 (0.44) PDE10AALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL1610314 0.83 PDE10A (0.44) PDE10AALDH1A1SMN1; SMN2CHRM3PDE4A
SCHEMBL1609894 0.83 PDE10A (0.43) PDE10AALDH1A1SMN1; SMN2MAPTLMNA

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 1704/4885PLAU 4823/4885ALDH1A1 1562/4885

“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.