SCHEMBL24409790

SCHEMBL24409790

O=C(O)COc1nc(-c2ccc(F)cn2)n(-c2ccc(Cl)cn2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 3/20 0.38
▸ HTR1A P08908 3/20 0.35
▸ DRD2 P14416 3/20 0.35
▸ DRD4 P21917 3/20 0.35
▸ HTR2A P28223 3/20 0.35
▸ HTR2C P28335 3/20 0.35
▸ HTR7 P34969 3/20 0.35
▸ DRD3 P35462 3/20 0.35
▸ TMEM97 Q5BJF2 2/20 0.35
▸ SIGMAR1 Q99720 2/20 0.35
▸ LDHA P00338 1/20 0.34
▸ MALT1 Q9UDY8 2/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ CNR2 P34972 3/20 0.33
▸ CNR1 P21554 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NTRK1 P04629 1/20 0.32

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
SCHEMBL30697304 1.00 P2RX7 (0.38) P2RX7HTR1ADRD2DRD4HTR2A
SCHEMBL29525358 0.89 P2RX7 (0.40) P2RX7HTR1ADRD2DRD4HTR2A
SCHEMBL29525135 0.89 P2RX7 (0.40) P2RX7HTR1ADRD2DRD4HTR2A
SCHEMBL24409835 0.89 P2RX7 (0.40) P2RX7HTR1ADRD2DRD4HTR2A
SCHEMBL24406742 0.84 PTGDR2 (0.41) P2RX7LDHAPTGDR2CNR2CNR1
SCHEMBL24407576 0.79 LPAR2 (0.37) PTGDR2CNR2CNR1ALDH1A1TSHR
SCHEMBL31392413 0.79 LPAR2 (0.37) PTGDR2CNR2CNR1ALDH1A1TSHR
SCHEMBL26940207 0.79 TDP1 (0.38) PTGDR2TSHR
SCHEMBL24409743 0.79 P2RX7 (0.37) P2RX7HTR1ADRD2DRD4HTR2A
SCHEMBL30519965 0.79 P2RX7 (0.37) P2RX7HTR1ADRD2DRD4HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12606542-B2 [(1,5-diheteroaryl-1H-1,2,4-triazol-3-yl)oxy] acetic acid derivatives as safeners for the protection of useful plants and crop plants BAYER AKTIENGESELLSCHAFT (DE) 2026-04-21 — — US disclosed
US-20230416229-A1 [(1,5-DIHETEROARYL-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2023-12-28 — — US disclosed
EP-4240731-A1 [(1,5-DIHETEROARYL-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS Bayer Aktiengesellschaft (DE) 2023-09-13 — — EP disclosed
CN-116528674-A [ (1, 5-bis (heteroaryl) -1H-1,2, 4-triazol-3-yl) oxy ] acetic acid derivatives as safeners for protecting useful plants and crop plants 拜耳公司 2023-08-01 — — CN disclosed
WO-2022096449-A1 [(1,5-DIHETEROARYL-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-05-12 — — WO disclosed
WO-2022096449-A1 [(1,5-DIHETEROARYL-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-05-12 — — 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 (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-20230416229-A1 [(1,5-DIHETEROARYL-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS CYP4Z1, HAAO, HAO1 P2RX7 3536/4885HTR1A 2255/4885DRD2 2002/4885
US-12606542-B2 [(1,5-diheteroaryl-1H-1,2,4-triazol-3-yl)oxy] acetic acid derivatives as safeners for the protection of useful plants and crop plants CBR3, CBR1, HACL2 P2RX7 4448/4885HTR1A 3113/4885DRD2 1590/4885

“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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