SCHEMBL675169

SCHEMBL675169

CCCCNC(=O)n1c(NC(C)=O)nc2ccccc21

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.79
▸ ALDH1A1 P00352 1/20 0.79
▸ ASAH1 Q13510 7/20 0.62
▸ POLB P06746 2/20 0.57
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ HTT P42858 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ NOD1 Q9Y239 1/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ TNF P01375 1/20 0.47
▸ SAE1 Q9UBE0 1/20 0.47

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
SCHEMBL6926893 0.90 TSHR (0.79) TSHRALDH1A1ASAH1POLBHTT
Benomyl SCHEMBL15681 0.88 TSHR (1.00) TSHRALDH1A1ASAH1POLBHTT
Benomyl SCHEMBL29379464 0.88 TSHR (1.00) TSHRALDH1A1ASAH1POLBHTT
Benomyl SCHEMBL8379451 0.88 TSHR (1.00) TSHRALDH1A1ASAH1POLBHTT
SCHEMBL11884864 0.88 TSHR (0.74) TSHRALDH1A1ASAH1HTTLMNA
Benomyl SCHEMBL27841656 0.88 TSHR (0.94) TSHRALDH1A1ASAH1POLBCYP1A2
Benomyl SCHEMBL3962065 0.87 TSHR (0.98) TSHRALDH1A1ASAH1POLBHTT
SCHEMBL7102687 0.86 TSHR (0.83) TSHRALDH1A1ASAH1POLBHTT
Benomyl SCHEMBL28721488 0.85 TSHR (0.94) TSHRALDH1A1ASAH1POLBHTT
Benomyl SCHEMBL23632884 0.84 TSHR (0.92) TSHRALDH1A1ASAH1POLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220168278-A1 LOW DOSE FLURALANER COMPOSITIONS FOR PROTECTION AGAINST PARASITIC INVERTEBRATE PEST VIRBAC (FR) 2022-06-02 — — US disclosed
EP-3927341-A1 LOW DOSE FLURALANER COMPOSITIONS FOR PROTECTION AGAINST PARASITIC INVERTEBRATE PEST VIRBAC (FR) 2021-12-29 — — EP disclosed
US-10899932-B2 Non-amphoteric, quaternisable and water-soluble polymers for modifying the surface charge of solid particles BASF SE (DE) 2021-01-26 — — US disclosed
WO-2020201440-A1 LOW DOSE FLURALANER COMPOSITIONS FOR PROTECTION AGAINST PARASITIC INVERTEBRATE PEST VIRBAC (FR) 2020-10-08 — — WO disclosed
US-10759767-B2 Compositions comprising a triazole compound BASF Agro B.V. (NL) 2020-09-01 — — US disclosed
EP-3646731-A1 PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2020-05-06 — — EP disclosed
EP-3300602-B1 PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2020-03-25 — — EP disclosed
EP-3498098-A1 COMPOSITIONS COMPRISING A TRIAZOLE COMPOUND BASF Agro B.V. (NL) 2019-06-19 — — EP disclosed
US-20180334569-A9 NON-AMPHOTERIC, QUATERNISABLE AND WATER-SOLUBLE POLYMERS FOR MODIFYING THE SURFACE CHARGE OF SOLID PARTICLES BASF SE (DE) 2018-11-22 — — US disclosed
US-20180296459-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2018-10-18 — — US disclosed
WO-2008095913-A2 PESTICIDAL MIXTURES BASF SE (DE) 2008-08-14 — — WO disclosed
WO-2008092818-A2 PESTICIDAL MIXTURES BASF SE (DE) 2008-08-07 — — WO disclosed
US-20080125318-A1 Fungicidal Mixtures Containing Enestroburin and at Least One Active Substance from the Group of Azoles BASF AKTIENGESELLSCHAFT (DE) 2008-05-29 — — US disclosed
WO-2008034787-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2008-03-27 — — WO disclosed
US-20080064597-A1 Fungicidal Mixtures BASF AKTIENGESELLSCHAFT (DE) 2008-03-13 — — US disclosed
US-20080045414-A1 Of 2,3-dimethyl-3-(3-pyridyl)-5-(4-chlorophenyl)isoxazolidine and at least one other fungicide; reduced application rate, broadened spectrum; synergistic against phytopathogens BASF AKTIENGESELLSCHAFT (DE) 2008-02-21 — — US disclosed
US-20080039319-A1 Fungicidal Mixtures and Novel Triazolopyrimidines BASF AKTIENGESELLSCHAFT (DE) 2008-02-14 — — US disclosed
US-20080039320-A1 Use Of Menadione BASF AKTIENGESELLSCHAFT (DE) 2008-02-14 — — US disclosed
EP-1849364-A1 Composition comprising a glucan or a glucan derivative and a pesticide and methods for improving plant health BASF AKTIENGESELLSCHAFT (DE) 2007-10-31 — — EP disclosed
US-20060167019-A1 Fungicidal mixtures based on a trizolopyrimidine derivative BASF AKTIENGESELLSCHAFT (DE) 2006-07-27 — — US 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 (9 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-20080064597-A1 Fungicidal Mixtures ARSA, NAT1, DDT TSHR 2433/4885ALDH1A1 180/4885ASAH1 865/4885
US-20080039320-A1 Use Of Menadione MANBA, MGAM2, MGAM TSHR 3198/4885ALDH1A1 712/4885ASAH1 3625/4885
US-20220168278-A1 LOW DOSE FLURALANER COMPOSITIONS FOR PROTECTION AGAINST PARASITIC INVERTEBRATE PEST P2RX7, CAT, PDE8A TSHR 294/4885ALDH1A1 3318/4885ASAH1 1985/4885
US-20080125318-A1 Fungicidal Mixtures Containing Enestroburin and at Least One Active Substance from the Group of Azoles ERG28, STS, SNX1 TSHR 4445/4885ALDH1A1 970/4885ASAH1 1443/4885
US-20180296459-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS PUF60, POLR1C, PICALM TSHR 4741/4885ALDH1A1 4122/4885ASAH1 3407/4885
US-20060167019-A1 Fungicidal mixtures based on a trizolopyrimidine derivative FBL, POLRMT, MORF4L1 TSHR 4346/4885ALDH1A1 1572/4885ASAH1 3415/4885
US-20080045414-A1 Of 2,3-dimethyl-3-(3-pyridyl)-5-(4-chlorophenyl)isoxazolidine and at least one other fungicide; reduced application rate, broadened spectrum; synergistic against phytopathogens DDT, CYP4X1, STS TSHR 2869/4885ALDH1A1 3457/4885ASAH1 4212/4885
US-10759767-B2 Compositions comprising a triazole compound CYP1B1, CYP3A5, CYP4B1 TSHR 3524/4885ALDH1A1 695/4885ASAH1 2084/4885
US-20080039319-A1 Fungicidal Mixtures and Novel Triazolopyrimidines ATIC, ARSA, AOC1 TSHR 1888/4885ALDH1A1 78/4885ASAH1 1605/4885

“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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