SCHEMBL17905261

SCHEMBL17905261

C[C@H](N)C(=O)O[C@@H](C)[C@@H](Cc1ccccc1)OCC1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.38
▸ SLC1A3 P43003 3/20 0.38
▸ SLC1A2 P43004 3/20 0.38
▸ SLC1A1 P43005 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CTRB1 P17538 3/20 0.37
▸ ALPI P09923 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ XIAP P98170 1/20 0.37
▸ SLC7A5 Q01650 1/20 0.37
▸ SLC6A2 P23975 2/20 0.36
▸ TAAR1 Q96RJ0 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36

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
SCHEMBL17905251 0.82 SLC1A3 (0.41) SIGMAR1SLC1A3SLC1A2SLC1A1MEN1
SCHEMBL17905254 0.80 MEN1 (0.46) SIGMAR1MEN1KMT2ACTRB1ALPI
SCHEMBL17900617 0.80 PTGIR (0.40) SLC1A3SLC1A2SLC1A1BCHEACHE
SCHEMBL17905499 0.79 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1SLC7A5
SCHEMBL17905081 0.78 PPARG (0.47) —
SCHEMBL17905145 0.77 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1
SCHEMBL17900550 0.76 GPR88 (0.38) SLC1A3SLC1A2SLC1A1TAAR1BCHE
SCHEMBL17901642 0.76 ALPI (0.47) SIGMAR1SLC1A3SLC1A2SLC1A1MEN1
SCHEMBL17905625 0.75 SLC1A3 (0.45) SLC1A3SLC1A2SLC1A1
SCHEMBL17905490 0.74 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1

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
EP-3240413-B1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-05-13 — — EP disclosed
US-10433555-B2 Picolinamide compounds with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-10-08 — — US disclosed
WO-2016109289-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109288-A1 USE OF PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — 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-10433555-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 SIGMAR1 1339/4885SLC1A3 1360/4885SLC1A2 717/4885

“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.

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