SCHEMBL17901082

SCHEMBL17901082

CC[C@H](OC(=O)[C@H](C)NC(=O)OC(C)(C)C)[C@H](C)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 6/20 0.43
▸ SYK P43405 1/20 0.42
▸ MMP13 P45452 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CTSS P25774 3/20 0.40
▸ ATM Q13315 1/20 0.40
▸ EPHX2 P34913 1/20 0.39
▸ MTNR1A P48039 1/20 0.39
▸ MTNR1B P49286 1/20 0.39
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 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
SCHEMBL17901087 1.00 CTSK (0.43) CTSKSYKMMP13KDM4EHPGD
SCHEMBL17901143 1.00 CTSK (0.43) CTSKSYKMMP13KDM4EHPGD
SCHEMBL17901123 1.00 CTSK (0.43) CTSKSYKMMP13KDM4EHPGD
SCHEMBL17901218 0.91 CTSK (0.46) CTSKSYKMMP13KDM4EHPGD
SCHEMBL20682879 0.91 CTSK (0.46) CTSKSYKMMP13KDM4EHPGD
SCHEMBL17901034 0.91 CTSK (0.46) CTSKSYKMMP13KDM4EHPGD
SCHEMBL17901224 0.91 CTSK (0.46) CTSKSYKMMP13KDM4EHPGD
SCHEMBL17901232 0.90 MMP13 (0.43) CTSKMMP13KDM4EHPGDGLA
SCHEMBL17901222 0.90 MMP13 (0.43) CTSKMMP13KDM4EHPGDGLA
SCHEMBL17901221 0.90 MMP13 (0.43) CTSKMMP13KDM4EHPGDGLA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3240419-B1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-05-06 — — EP disclosed
US-10188109-B2 Picolinamide compounds with fungicidal activity DOW AGROSCIENCES LLC (US) 2019-01-29 — — US disclosed
US-20170360038-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY CORTEVA AGRISCIENCE LLC 2017-12-21 — — US disclosed
WO-2016109303-A1 USE OF PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109302-A1 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 (2 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-20170360038-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY PFAS, CASP2, CYP1A2 CTSK 2808/4885SYK 4809/4885MMP13 3395/4885
US-10188109-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 CTSK 2808/4885SYK 4809/4885MMP13 3395/4885

“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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