SCHEMBL17905201

SCHEMBL17905201

COc1ccnc(C(=O)N[C@@H](C)C(=O)O[C@@H](C)[C@H](Oc2ccc(F)cc2)C2CCCC2)c1OC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.33
▸ HCRTR1 O43613 2/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MET P08581 2/20 0.31
▸ AXL P30530 1/20 0.31
▸ APLNR P35414 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ PDGFRA P16234 1/20 0.30
▸ KDR P35968 1/20 0.30
▸ ACACB O00763 1/20 0.30

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
SCHEMBL17905149 0.93 XBP1 (0.35) MAPTNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL17905193 0.92 MAPT (0.35) MAPTNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL17905137 0.92 APLNR (0.33) MAPTHCRTR1HCRTR2METAXL
SCHEMBL17905181 0.92 HCRTR1 (0.33) HCRTR1HCRTR2METAPLNRKDR
SCHEMBL17905134 0.91 ALDH1A1 (0.33) MAPTHCRTR1HCRTR2NPC1HPGD
SCHEMBL17905649 0.90 TDP1 (0.35) MAPTPDGFRAKDRACACB
SCHEMBL17905151 0.89 SMN1; SMN2 (0.33) MAPTHCRTR1HCRTR2NPC1HPGD
SCHEMBL17905223 0.89 MAPT (0.35) MAPTL3MBTL1
SCHEMBL17896230 0.87 HTT (0.35) HPGDL3MBTL1
SCHEMBL17905159 0.87 HTT (0.35) HPGDL3MBTL1

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-2016109288-A1 USE OF PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-07-07 — — WO disclosed
WO-2016109289-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 (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 MAPT 1306/4885HCRTR1 575/4885HCRTR2 655/4885

“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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