SCHEMBL2583594

SCHEMBL2583594

CNC(=O)OC1CCC(O)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.39
SLC6A2 P23975 2/20 0.35
SLC6A3 Q01959 2/20 0.35
SLC6A4 P31645 1/20 0.35
ACHE P22303 5/20 0.34
ALDH1A1 P00352 2/20 0.33
KCNA3 P22001 1/20 0.33
POLL Q9UGP5 1/20 0.33
PGR P06401 1/20 0.33
GAA P10253 1/20 0.33
PTGS1 P23219 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
CHRM1 P11229 1/20 0.33
CTSV O60911 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
KAT2B Q92831 1/20 0.32

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
SCHEMBL12159639 0.84 BCHE (0.39) BCHESLC6A2SLC6A3SLC6A4ACHE
SCHEMBL30291012 0.80 ALDH1A1 (0.34) SLC6A2SLC6A3SLC6A4ALDH1A1POLL
SCHEMBL20420694 0.79 MEN1 (0.36) SLC6A2SLC6A3SLC6A4ALDH1A1POLL
SCHEMBL11203577 0.78 IDO1 (0.51) CTSVCTSLCTSSCTSK
SCHEMBL5318520 0.75 SLC6A2 (0.49) BCHESLC6A2SLC6A3SLC6A4ACHE
SCHEMBL21798462 0.75 SSTR4 (0.41) BCHEACHEGAAMAPK1
SCHEMBL20480799 0.74 SLC6A4 (0.58) SLC6A2SLC6A3SLC6A4MAPK1CHRM1
SCHEMBL9976868 0.72 POLB (0.55) SLC6A2SLC6A3SLC6A4ALDH1A1POLB
SCHEMBL9036022 0.71 EPHX2 (0.40) BCHEACHEALDH1A1PGRGAA
SCHEMBL5206019 0.71 MEN1 (0.41) POLLGAA

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-8586611-B2 Fungicidal carboxamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-11-19 US disclosed
EP-1948649-B1 FUNGICIDAL CARBOXAMIDES DU PONT (US) 2013-06-26 EP disclosed
US-20110269712-A1 Fungicidal Carboxamides BISAHA JOHN JOSEPH 2011-11-03 US disclosed
WO-2008091594-A2 FUNGICIDAL MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-07-31 WO disclosed
EP-1948649-A2 FUNGICIDAL CARBOXAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-07-30 EP disclosed
WO-2007014290-A2 FUNGICIDAL CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-02-01 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-20110269712-A1 Fungicidal Carboxamides NAT1, PFAS, CHRM1 BCHE 1723/4885SLC6A2 4188/4885SLC6A3 4025/4885

“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.