SCHEMBL29359755

SCHEMBL29359755

CC(C)C(O)(Cn1cncn1)c1ccc(Oc2ccc(Cl)cc2)cc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 13/20 0.43
CYP2C9 P11712 11/20 0.43
CYP2C19 P33261 11/20 0.43
CYP1A2 P05177 6/20 0.43
CYP2D6 P10635 6/20 0.43
KCNH2 Q12809 3/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 2/20 0.41
CYP2B6 P20813 1/20 0.41
CYP3A5 P20815 1/20 0.41
CYP3A7 P24462 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP3A43 Q9HB55 1/20 0.41
CYP46A1 Q9Y6A2 1/20 0.41
HSP90AA1 P07900 2/20 0.39
CYP19A1 P11511 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
ADRA1A P35348 1/20 0.39

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
SCHEMBL15823085 1.00 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL29430293 1.00 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL15822678 1.00 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL14645415 1.00 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL19615889 0.96 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL29427680 0.96 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL20337026 0.91 CYP3A4 (0.42) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
Chlorothalonil SCHEMBL19357020 0.91 AR (0.41) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL28003265 0.89 CYP3A4 (0.42) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
Zinc Ion SCHEMBL19357028 0.89 CYP3A4 (0.37) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6

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 137 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4618760-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2025-09-24 EP claimed
EP-4618761-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2025-09-24 EP claimed
WO-2024104814-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2024-05-23 WO claimed
EP-4702006-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS XVI BASF SE (DE) 2026-03-04 EP disclosed
US-12538924-B2 Pesticidally active heterocyclic derivatives with sulfur containing substituents SYNGENTA CROP PROTECTION AG (CH) 2026-02-03 US disclosed
US-12528788-B2 Pesticidally active benzene- and azine-amide compounds SYNGENTA CROP PROTECTION AG (CH) 2026-01-20 US disclosed
EP-4662210-A1 NEW SUBSTITUTED QUINOLINE COMPOUNDS FOR COMBATITNG PHYTOPATHOGENIC FUNGI BASF SE (DE) 2025-12-17 EP disclosed
US-20250338848-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-11-06 US disclosed
US-20250295112-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-09-25 US disclosed
EP-4619399-A1 NEW SUBSTITUTED TETRAHYDROBENZOXAZEPINE BASF SE (DE) 2025-09-24 EP disclosed
EP-4618760-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2025-09-24 EP disclosed
US-20220061324-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2022-03-03 US disclosed
US-11259524-B2 Microbiocidal oxadiazole derivatives SYNGENTA PARTICIPATIONS AG (CH) 2022-03-01 US disclosed
EP-3621965-B1 IMIDAZOPYRIMIDINE DERIVATIVES WITH SULFUR CONTAINING PHENYL AND PYRIDYL SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2022-02-23 EP disclosed
WO-2022033906-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS VIII BASF SE (DE) 2022-02-17 WO disclosed
US-11241011-B2 Microbiocidal quinoline (thio)carboxamide derivatives SYNGENTA PARTICIPATIONS AG (CH) 2022-02-08 US disclosed
US-20220030867-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2022-02-03 US disclosed
CN-113979962-A Fungicidal compositions 先正达参股股份有限公司 2022-01-28 CN disclosed
CN-108368098-B Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2022-01-28 CN disclosed
WO-2022017836-A1 FUNGICIDAL COMPOSITIONS COMPRISING (R)-2-[4-(4-CHLOROPHENOXY)-2-(TRIFLUOROMETHYL)PHENYL]-1- (1,2,4-TRIAZOL-1-YL)PROPAN-2-OL BASF Agro B.V. (NL) 2022-01-27 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 (8 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-20250338848-A1 FUNGICIDAL COMPOSITIONS CYP3A7, DHCR7, CASP7 CYP3A4 23/4885CYP2C9 84/4885CYP2C19 151/4885
US-12538924-B2 Pesticidally active heterocyclic derivatives with sulfur containing substituents CBR3, CBR1, CYCS CYP3A4 1742/4885CYP2C9 2010/4885CYP2C19 3896/4885
US-11241011-B2 Microbiocidal quinoline (thio)carboxamide derivatives IFNG, TLR1, IDO1 CYP3A4 473/4885CYP2C9 1178/4885CYP2C19 981/4885
US-12528788-B2 Pesticidally active benzene- and azine-amide compounds CBR3, CBR1, DDT CYP3A4 261/4885CYP2C9 269/4885CYP2C19 1330/4885
US-20220061324-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, ACHE, AADAC CYP3A4 1989/4885CYP2C9 1257/4885CYP2C19 3043/4885
US-20250295112-A1 FUNGICIDAL COMPOSITIONS MTX2, MTX1, AOX1 CYP3A4 47/4885CYP2C9 6/4885CYP2C19 26/4885
US-20220030867-A1 FUNGICIDAL COMPOSITIONS CYP1B1, CYP4B1, CYP3A43 CYP3A4 23/4885CYP2C9 14/4885CYP2C19 4/4885
US-11259524-B2 Microbiocidal oxadiazole derivatives PRF1, NOX1, ARG1 CYP3A4 137/4885CYP2C9 227/4885CYP2C19 223/4885

“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.