SCHEMBL17902237

SCHEMBL17902237

COc1cc(C)ccc1C(c1ccc(C)cc1OC)[C@H](C)OC(=O)[C@H](C)N

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 7/20 0.40
▸ ACHE P22303 1/20 0.39
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ TAS1R3 Q7RTX0 1/20 0.36
▸ TAS1R1 Q7RTX1 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
SCHEMBL17902244 0.89 LPAR1 (0.40) LPAR1ACHETAS1R3TAS1R1
SCHEMBL20348365 0.86 LPAR1 (0.38) LPAR1ACHENPC1RAB9A
SCHEMBL17902137 0.86 ALDH1A1 (0.42) NPC1
SCHEMBL17902243 0.86 ADRA2A (0.44) LPAR1NPC1
SCHEMBL17902355 0.85 GRIN2D (0.41) LPAR1
SCHEMBL17902592 0.85 MEN1 (0.36) —
SCHEMBL26321679 0.85 GRIN2D (0.41) LPAR1
SCHEMBL20662037 0.84 GRM1 (0.36) TAS1R3TAS1R1
SCHEMBL17902368 0.83 CTSA (0.37) TAS1R3TAS1R1
SCHEMBL17902367 0.83 CTSA (0.37) TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11751568-B2 Picolinamide compounds with fungicidal activity CORTEVA AGRISCIENCE LLC (US) 2023-09-12 — — US disclosed
US-11751568-B2 Picolinamide compounds with fungicidal activity CORTEVA AGRISCIENCE LLC (US) 2023-09-12 — — US disclosed
EP-3808181-A1 USE OF PICOLINAMIDE COMPOUNDS AS FUNGICIDES Dow AgroSciences LLC (US) 2021-04-21 — — EP disclosed
EP-3240773-B9 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2021-01-13 — — EP disclosed
EP-3240424-B1 USE OF PICOLINAMIDE COMPOUNDS AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2020-09-16 — — EP disclosed
EP-3240773-B1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-06-03 — — EP disclosed
US-10588318-B2 Picolinamide compounds with fungicidal activity DOW AGROSCIENCES LLC (US) 2020-03-17 — — US disclosed
US-10182568-B2 Use of picolinamide compounds as fungicides DOW AGROSCIENCES LLC (US) 2019-01-22 — — US disclosed
WO-2016122802-A1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2016-08-04 — — WO disclosed
WO-2016109257-A1 USE OF PICOLINAMIDE COMPOUNDS AS FUNGICIDES 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 (3 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-10182568-B2 Use of picolinamide compounds as fungicides PFAS, FKBP2, FKBP14 LPAR1 2667/4885ACHE 1776/4885NPC1 1509/4885
US-11751568-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 LPAR1 3045/4885ACHE 2340/4885NPC1 1093/4885
US-10588318-B2 Picolinamide compounds with fungicidal activity PFAS, CASP2, CYP1A2 LPAR1 3045/4885ACHE 2340/4885NPC1 1093/4885

“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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