SCHEMBL2581504

SCHEMBL2581504

CN[C@@H]1CC[C@H](O)c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.53
▸ SLC6A2 P23975 1/20 0.49
▸ SLC6A4 P31645 1/20 0.49
▸ SLC6A3 Q01959 1/20 0.49

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
SCHEMBL2402634 1.00 PDPK1 (0.53) PDPK1SLC6A2SLC6A4SLC6A3
SCHEMBL2578485 1.00 PDPK1 (0.53) PDPK1SLC6A2SLC6A4SLC6A3
SCHEMBL2399818 0.83 SLC6A2 (0.53) PDPK1SLC6A2SLC6A4SLC6A3
SCHEMBL30290975 0.80 MEN1 (0.41) —
SCHEMBL14592022 0.80 MEN1 (0.41) —
SCHEMBL5206019 0.80 MEN1 (0.41) —
SCHEMBL11591514 0.79 LMNA (0.47) —
SCHEMBL11603441 0.78 PTGDR2 (0.42) —
SCHEMBL11600497 0.78 PTGDR2 (0.42) —
SCHEMBL11600503 0.78 PTGDR2 (0.42) —

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-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

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 PDPK1 2577/4885SLC6A2 4188/4885SLC6A4 4195/4885

“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.

Send feedback