SCHEMBL18335060

SCHEMBL18335060

CC(NC(=O)c1ccccc1C(F)(F)F)C(OCc1ccccc1)c1ncc(C#CC2CC2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 5/20 0.37
▸ SLC1A3 P43003 1/20 0.36
▸ SLC1A2 P43004 1/20 0.36
▸ SLC1A1 P43005 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ UGCG Q16739 7/20 0.34
▸ CYP3A4 P08684 5/20 0.34
▸ ACACB O00763 1/20 0.34
▸ EGLN1 Q9GZT9 1/20 0.33
▸ MALT1 Q9UDY8 1/20 0.33

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
SCHEMBL18335143 0.84 PTGES (0.39) PTGES
SCHEMBL18335091 0.82 P2RX7 (0.41) PTGESEGLN1
SCHEMBL18335151 0.72 SLC6A2 (0.37) PTGESCYP3A4
SCHEMBL18335114 0.72 SLC6A2 (0.37) PTGESCYP3A4EGLN1
SCHEMBL18335072 0.70 P2RX7 (0.38) EGLN1
SCHEMBL16240114 0.66 KMT2A (0.53) PTGESALDH1A1
SCHEMBL18335153 0.65 TRPA1 (0.36) PTGESEGLN1
SCHEMBL18335074 0.63 MEN1 (0.46) PTGESCYP3A4EGLN1
SCHEMBL16711954 0.63 EGLN1 (0.41) PTGESALDH1A1EGLN1
SCHEMBL16711953 0.63 EGLN1 (0.41) PTGESALDH1A1EGLN1

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-10029986-B2 Alkynyl pyridine-substituted amide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-07-24 — — US disclosed
US-20170008847-A1 ALKYNYL PYRIDINE-SUBSTITUTED AMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2017-01-12 — — US disclosed
EP-3109234-A1 ALKYNYLPYRIDINE-SUBSTITUTED AMIDE COMPOUND AND NOXIOUS ORGANISM CONTROL AGENT Nissan Chemical Industries, Ltd. (JP) 2016-12-28 — — EP 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-10029986-B2 Alkynyl pyridine-substituted amide compound and pesticide CHRM1, CHRM2, CHRM3 PTGES 3364/4885SLC1A3 1157/4885SLC1A2 2018/4885
US-20170008847-A1 ALKYNYL PYRIDINE-SUBSTITUTED AMIDE COMPOUND AND PESTICIDE CHRM1, CHRM2, CHRM3 PTGES 3364/4885SLC1A3 1157/4885SLC1A2 2018/4885

“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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