SCHEMBL29999593

SCHEMBL29999593

COC(=O)COc1nc(-c2ccc(Cl)cc2Cl)n(-c2ccc(Cl)cc2F)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 9/20 0.46
▸ LPAR2 Q9HBW0 1/20 0.39
▸ DPP4 P27487 2/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ DPP8 Q6V1X1 1/20 0.38
▸ DPP9 Q86TI2 1/20 0.38
▸ KCNN4 O15554 1/20 0.38
▸ CNR2 P34972 3/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ACLY P53396 1/20 0.37

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
SCHEMBL23447245 1.00 CNR1 (0.46) CNR1LPAR2DPP4CYP3A4DPP8
SCHEMBL30439038 0.94 CNR1 (0.43) CNR1LPAR2KCNN4KDM4EKMT2A
SCHEMBL23447227 0.92 CNR1 (0.41) CNR1DPP4
SCHEMBL30504677 0.90 CNR1 (0.41) CNR1CYP3A4KCNN4CNR2
SCHEMBL30504668 0.90 CNR1 (0.41) CNR1CYP3A4KCNN4CNR2
SCHEMBL23411404 0.89 TDP1 (0.42) CNR1CNR2KDM4E
SCHEMBL30897435 0.89 CNR1 (0.39) CNR1LPAR2KCNN4KDM4E
SCHEMBL30886895 0.89 CNR1 (0.39) CNR1LPAR2KCNN4KDM4E
SCHEMBL30897433 0.89 CNR1 (0.39) CNR1LPAR2KCNN4KDM4E
SCHEMBL25972331 0.89 CNR1 (0.43) CNR1CNR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583826-B2 [(1,5-diphenyl-1H-1,2,4-triazol-3-yl)oxy]acetic acid derivatives and salts thereof, crop protection compositions comprising them, methods for producing them and use thereof as safeners BAYER AKTIENGESELLSCHAFT (DE) 2026-03-24 — — US disclosed
EP-4065564-B1 [ (1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL) OXY ] ACETIC ACID DERIVATIVES AND SALTS THEREOF, USEFUL OR CULTIVATING AGENTS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS SAFENERS BAYER AG (DE) 2023-07-26 — — EP disclosed
US-20220388971-A1 [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, CROP PROTECTION COMPOSITIONS COMPRISING THEM, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-08 — — 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 (2 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-12583826-B2 [(1,5-diphenyl-1H-1,2,4-triazol-3-yl)oxy]acetic acid derivatives and salts thereof, crop protection compositions comprising them, methods for producing them and use thereof as safeners CBR3, CBR1, HACL2 CNR1 155/4885LPAR2 2152/4885DPP4 1582/4885
US-20220388971-A1 [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, CROP PROTECTION COMPOSITIONS COMPRISING THEM, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS CYP4Z1, GSTO1, AADAC CNR1 2315/4885LPAR2 2549/4885DPP4 476/4885

“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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