SCHEMBL26103897

SCHEMBL26103897

O=c1c(B(O)O)coc2cc(C(F)(F)F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.42
▸ PIM3 Q86V86 1/20 0.42
▸ MAOB P27338 2/20 0.40
▸ MCHR1 Q99705 1/20 0.39
▸ CYP1A2 P05177 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ MAPT P10636 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ TP53 P04637 2/20 0.37
▸ PIK3CA P42336 1/20 0.36
▸ ALOX12 P18054 2/20 0.36
▸ KIF11 P52732 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ HPGD P15428 4/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ NPC1 O15118 2/20 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
SCHEMBL26103434 0.77 PIM1 (0.45) PIM1PIM3MAOBCYP1A2CYP3A4
SCHEMBL31253938 0.73 MAOB (0.56) MAOBALDH1A1KDM4EMAOA
SCHEMBL17324007 0.73 CA1 (0.40) PIM1PIM3MAPTSMN1; SMN2TP53
SCHEMBL25311608 0.73 MAOB (0.56) MAOBALDH1A1KDM4EMAOA
SCHEMBL27697038 0.72 PTPN1 (0.43) PIM1PIM3MAOBMAPTSMN1; SMN2
SCHEMBL31253981 0.71 CA12 (0.50) MAOBCYP1A2CYP2C19MAPTSMN1; SMN2
SCHEMBL2926489 0.70 KDM4E (0.54) PIM1MAOBCYP1A2CYP2C9CYP2C19
SCHEMBL17708944 0.68 MAOA (0.62) PIM1PIM3MAOBCYP1A2CYP3A4
SCHEMBL30395860 0.68 MAOA (0.62) PIM1PIM3MAOBCYP1A2CYP3A4
SCHEMBL12289032 0.68 KDM4E (0.76) MAOBCYP1A2CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4676925-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Crop Protection AG (CH) 2026-01-14 — — EP disclosed
US-20250257053-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2025-08-14 — — US disclosed
WO-2024188755-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2024-09-19 — — WO disclosed
EP-4423080-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Crop Protection AG (CH) 2024-09-04 — — EP disclosed
WO-2023072945-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-05-04 — — WO disclosed
WO-2023072945-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-05-04 — — 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-20250257053-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS ACHE, DDT, AADAC PIM1 2920/4885PIM3 2238/4885MAOB 1422/4885

“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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