SCHEMBL18112862

SCHEMBL18112862

O=C(NC1CCCc2ccccc21)c1cc(C2CCN(C(=O)Cn3nc(C(F)F)cc3C(F)(F)F)CC2)ccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
DHODH Q02127 2/20 0.40
ALDH1A1 P00352 9/20 0.39
KDM4E B2RXH2 5/20 0.39
HPGD P15428 5/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
USP36 Q9P275 1/20 0.39
MAPT P10636 1/20 0.38
CYP2D6 P10635 3/20 0.38
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
MEN1 O00255 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
HTT P42858 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 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
SCHEMBL29458474 1.00 TSHR (0.41) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL19176101 0.92 TSHR (0.41) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL29458581 0.92 TSHR (0.41) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL18131639 0.92 TSHR (0.41) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL18112863 0.91 TSHR (0.42) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL29360345 0.91 TSHR (0.42) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL19176162 0.91 TSHR (0.42) TSHRDHODHALDH1A1KDM4EHPGD
SCHEMBL18112867 0.91 TSHR (0.41) TSHRALDH1A1KDM4EHPGDKMT2A
SCHEMBL19176075 0.91 TSHR (0.41) TSHRALDH1A1KDM4EHPGDKMT2A
SCHEMBL19176174 0.91 TSHR (0.45) TSHRDHODHALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4710766-A1 MIXTURES OF AMBRUTICIN WITH AT LEAST ONE FURTHER PESTICIDE BASF SE (DE) 2026-03-18 EP claimed
US-20250338849-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2025-11-06 US claimed
EP-4640052-A1 MIXTURES 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 WITH AT LEAST ONE FURTHER PESTICIDE I BASF SE (DE) 2025-10-29 EP claimed
US-20240225002-A1 FUNGICIDAL COMPOSITION CONTAINING OXADIAZOLE COMPOUNDS PI INDUSTRIES LTD. (IN) 2024-07-11 US claimed
EP-4346412-A1 FUNGICIDAL COMPOSITION CONTAINING OXADIAZOLE COMPOUNDS PI Industries Ltd. (IN) 2024-04-10 EP claimed
US-20240065271-A1 MIXTURES AND COMPOSITIONS COMPRISING FUSARICIDIN A, FUSARICIDIN B AND FUNGICIDES BASF SE (DE) 2024-02-29 US claimed
US-20230397607-A1 COMPOSITIONS COMPRISING MEFENTRIFLUCONAZOLE BASF Agro B.V. (NL) 2023-12-14 US claimed
US-11839214-B2 Fungicidal mixture comprising substituted pyridines BASF SE (DE) 2023-12-12 US claimed
CN-116634876-A Mixtures and compositions comprising Fusarium A, fusarium B and fungicides 巴斯夫欧洲公司 2023-08-22 CN claimed
EP-3978504-A1 CHIRAL 2,3-DIHYDROTHIAZOLO[3,2-A]PYRIMIDINE DERIVATIVES FOR COMBATING ANIMAL PESTS BASF SE (DE) 2022-04-06 EP claimed
WO-2019115343-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2019-06-20 WO claimed
US-20190098899-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2019-04-04 US claimed
WO-2019042800-A1 PESTICIDAL MIXTURES BASF SE (DE) 2019-03-07 WO claimed
WO-2019012380-A1 MIXTURES COMPRISING A FUNGICIDE AND A NITRIFICATION INHIBITOR SUCH AS 2-(3,4-DIMETHYL-1H-PYRAZOL-1-YL)SUCCINIC ACID (DMPSA) OR 3,4-DIMETHYL PYRAZOLIUM GLYCOLATE (DMPG) BASF SE (DE) 2019-01-17 WO claimed
EP-3426044-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2019-01-16 EP claimed
WO-2018202428-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED 3-PHENYL-5-(TRIFLUOROMETHYL)-1,2,4-OXADIAZOLES BASF SE (DE) 2018-11-08 WO claimed
WO-2018202737-A1 FUNGICIDAL MIXTURES COMPRISING TRIAZOLE COMPOUNDS BASF SE (DE) 2018-11-08 WO claimed
WO-2018177970-A1 PROCESS FOR PREPARING CHIRAL 2,3-DIHYDROTHIAZOLO[3,2-A]PYRIMIDIN-4-IUM COMPOUNDS BASF SE (DE) 2018-10-04 WO claimed
WO-2018050508-A1 PESTICIDAL MIXTURES BASF SE (DE) 2018-03-22 WO claimed
WO-2017153200-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2017-09-14 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-11839214-B2 Fungicidal mixture comprising substituted pyridines ME1, DPM1, TH TSHR 4645/4885DHODH 763/4885ALDH1A1 913/4885
US-20230397607-A1 COMPOSITIONS COMPRISING MEFENTRIFLUCONAZOLE CYP51A1, CYP3A43, CYP3A7 TSHR 4853/4885DHODH 878/4885ALDH1A1 2485/4885
US-20250338849-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES ME1, DPM1, ERG28 TSHR 4647/4885DHODH 799/4885ALDH1A1 1040/4885
US-20240225002-A1 FUNGICIDAL COMPOSITION CONTAINING OXADIAZOLE COMPOUNDS OXA1L, NOX1, NOX3 TSHR 3698/4885DHODH 340/4885ALDH1A1 63/4885
US-20240065271-A1 MIXTURES AND COMPOSITIONS COMPRISING FUSARICIDIN A, FUSARICIDIN B AND FUNGICIDES FLNB, FBP1, FOSB TSHR 2678/4885DHODH 271/4885ALDH1A1 1728/4885
US-20190098899-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES DDT, SNX3, SFXN3 TSHR 3975/4885DHODH 995/4885ALDH1A1 1035/4885

“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.