SCHEMBL649744

SCHEMBL649744

O=S(=O)(Nc1ccccc1Oc1ccccc1)C(F)(F)F

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 9/20 0.70
PTGS2 P35354 8/20 0.70
TSHR P16473 1/20 0.54
PTPN1 P18031 1/20 0.51
CA2 P00918 1/20 0.51
ACLY P53396 1/20 0.47
SLC22A12 Q96S37 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CACNA1H O95180 1/20 0.44
CACNA1B Q00975 1/20 0.44
ADRA2C P18825 1/20 0.44
GAA P10253 2/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL27595683 0.90 PTGS1 (0.59) PTGS1PTGS2PTPN1CA2SLC22A12
SCHEMBL10417318 0.84 PTGS1 (0.59) PTGS1PTGS2TSHRPTPN1CA2
SCHEMBL4372207 0.83 PTGS1 (1.00) PTGS1PTGS2SLC22A12
SCHEMBL10416897 0.83 PTGS1 (0.58) PTGS1PTGS2PTPN1SLC22A12
SCHEMBL11187994 0.79 PTGS1 (0.56) PTGS1PTGS2TSHRPTPN1CA2
SCHEMBL8719438 0.78 PTGS2 (0.68) PTGS1PTGS2TSHRACLYL3MBTL1
SCHEMBL9232555 0.78 TSHR (0.54) PTGS1PTGS2TSHRCA2ACLY
SCHEMBL6001500 0.77 PTPN1 (0.86) PTGS1PTGS2PTPN1CA2
SCHEMBL27182622 0.77 TSHR (0.53) PTGS1PTGS2TSHRCA2ACLY
SCHEMBL6000980 0.76 PTPN1 (0.63) PTGS1PTGS2PTPN1CA2ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239759-A1 ISOXAZOLINE COMPOSITIONS AND THEIR USE AS ANTIPARASITICS INTERVET INC. (US) 2024-07-18 US disclosed
CN-117986154-A Antiparasitic compounds 英特维特国际股份有限公司 2024-05-07 CN disclosed
US-20240043385-A1 ANTHELMINTIC COMPOUNDS COMPRISING A PYRIDINE STRUCTURE INTERVET INC. (US) 2024-02-08 US disclosed
US-20240043446-A1 ANTHELMINTIC COMPOUNDS COMPRISING A THIENOPYRIDINE STRUCTURE INTERVET INC. (US) 2024-02-08 US disclosed
EP-4284509-A1 ANTIPARASITIC COMPOUNDS Intervet International B.V. (NL) 2023-12-06 EP disclosed
CN-116964031-A Antiparasitic compounds 英特维特国际股份有限公司 2023-10-27 CN disclosed
CN-116600807-A Insect repellent compound comprising thienopyridine structure 英特维特国际股份有限公司 2023-08-15 CN disclosed
US-20230148316-A1 ANTHELMINTIC COMPOUNDS COMPRISING A QUINOLINE STRUCTURE INTERVET INC. (US) 2023-05-11 US disclosed
US-20230110397-A1 ANTHELMINTIC COMPOUNDS COMPRISING AZAINDOLES STRUCTURE INTERVET INC. (US) 2023-04-13 US disclosed
EP-2545777-B2 Use of an isoxazoline composition as antiparasitic INTERVET INT BV (NL) 2023-01-18 EP disclosed
WO-2007079010-A2 CARBONATES OF FENICOL ANTIBIOTICS SCHERING-PLOUGH LTD. (CH) 2007-07-12 WO disclosed
US-20070155799-A1 CARBONATES OF FENICOL ANTIBIOTICS INTERVET INC. 2007-07-05 US disclosed
EP-1799636-A2 CONTROL OF PARASITES IN ANIMALS BY THE USE OF NOVEL TRIFLUOROMETHANESULFONANILIDE OXIME ETHER DERIVATIVES Schering-Plough Ltd. (CH) 2007-06-27 EP disclosed
WO-2006135648-A2 CONTROL OF PARASITES IN ANIMALS BY N-[(PHENYLOXY)PHENYL]-1,1,1-TRIFLUOROMETHANESULFONAMIDE AND N-[(PHENYLSULFANYL)PHENYL]-1,1,1-TRIFLUOROMETHANESULFONAMIDE DERIVATIVES SCHERING-PLOUGH LTD. (CH) 2006-12-21 WO disclosed
US-20060281695-A1 Control of parasites in animals by N-[(phenyloxy)phenyl]-1,1,1-trifluoromethanesulfonamide and N-[(phenylsulfanyl)phenyl]-1,1,1-trifluoromethanesulfonamide derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2006-12-14 US disclosed
US-20060281695-A1 Control of parasites in animals by N-[(phenyloxy)phenyl]-1,1,1-trifluoromethanesulfonamide and N-[(phenylsulfanyl)phenyl]-1,1,1-trifluoromethanesulfonamide derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2006-12-14 US disclosed
US-20060128779-A1 Control of parasites in animals by the use of parasiticidal 2-phenyl-3-(1H-pyrrol-2-yl)acrylonitrile derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2006-06-15 US disclosed
WO-2006055565-A2 CONTROL OF PARASITES IN ANIMALS BY THE USE OF PARASITICIDAL 2-PHENYL-3-(1H-PYRROL-2-YL) ACRYLONITRILE DERIVATIVES SCHERING-PLOUGH LTD. (CH) 2006-05-26 WO disclosed
WO-2006034333-A2 CONTROL OF PARASITES IN ANIMALS BY THE USE OF NOVEL TRIFLUOROMETHANESULFONANILIDE OXIME ETHER DERIVATIVES SCHERING-PLOUGH LTD. (CH) 2006-03-30 WO disclosed
US-20060063841-A1 Parasiticides; nematocides; crop protection SCHERING-PLOUGH LTD. (CH) 2006-03-23 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-20240043385-A1 ANTHELMINTIC COMPOUNDS COMPRISING A PYRIDINE STRUCTURE HRH4, PNPO, NME4 PTGS1 450/4885PTGS2 533/4885TSHR 4610/4885
US-20060128779-A1 Control of parasites in animals by the use of parasiticidal 2-phenyl-3-(1H-pyrrol-2-yl)acrylonitrile derivatives PNN, AADAC, EPX PTGS1 460/4885PTGS2 185/4885TSHR 3265/4885
US-20070155799-A1 CARBONATES OF FENICOL ANTIBIOTICS CYP4F3, TET1, CYP4F2 PTGS1 589/4885PTGS2 1206/4885TSHR 3125/4885
US-20240043446-A1 ANTHELMINTIC COMPOUNDS COMPRISING A THIENOPYRIDINE STRUCTURE DHODH, NISCH, DDT PTGS1 177/4885PTGS2 187/4885TSHR 2866/4885
US-20060063841-A1 Parasiticides; nematocides; crop protection TRHDE, DDT, EPHX1 PTGS1 1332/4885PTGS2 1406/4885TSHR 1334/4885
US-20230148316-A1 ANTHELMINTIC COMPOUNDS COMPRISING A QUINOLINE STRUCTURE DHX35, DDX5, DHODH PTGS1 806/4885PTGS2 698/4885TSHR 4731/4885
US-20060281695-A1 Control of parasites in animals by N-[(phenyloxy)phenyl]-1,1,1-trifluoromethanesulfonamide and N-[(phenylsulfanyl)phenyl]-1,1,1-trifluoromethanesulfonamide derivatives ELANE, CTRL, PIGO PTGS1 296/4885PTGS2 1435/4885TSHR 2010/4885
US-20230110397-A1 ANTHELMINTIC COMPOUNDS COMPRISING AZAINDOLES STRUCTURE AADAC, HNMT, NISCH PTGS1 1492/4885PTGS2 1123/4885TSHR 4483/4885
US-20240239759-A1 ISOXAZOLINE COMPOSITIONS AND THEIR USE AS ANTIPARASITICS PRDX5, TUBA3C, TUBA1C PTGS1 1988/4885PTGS2 1369/4885TSHR 3649/4885

“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.