SCHEMBL17609373

SCHEMBL17609373

CCS(=O)(=O)c1cc(C(F)(F)F)cnc1-c1nc2cc(C3(C#N)CC3)cnc2n1C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.37
▸ TRPM8 Q7Z2W7 1/20 0.34
▸ DDR1 Q08345 1/20 0.32
▸ TNF P01375 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ LRRK2 Q5S007 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30

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
SCHEMBL17609372 0.97 POLB (0.36) POLBTRPM8DDR1TNFALDH1A1
SCHEMBL17844096 0.96 POLB (0.39) POLBTRPM8DDR1TNFALDH1A1
SCHEMBL29904936 0.96 POLB (0.39) POLBTRPM8DDR1TNFALDH1A1
SCHEMBL17858042 0.93 POLB (0.38) POLBTRPM8DDR1TNFALDH1A1
SCHEMBL24696189 0.88 POLB (0.38) POLBTRPM8TNF
SCHEMBL21586201 0.88 POLB (0.38) POLBTRPM8TNF
SCHEMBL30401655 0.88 POLB (0.38) POLBTRPM8TNF
SCHEMBL30122145 0.88 POLB (0.38) POLBTRPM8TNF
SCHEMBL29748523 0.85 — —
SCHEMBL17844106 0.85 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106715428-B Pesticidally active tetracyclic derivatives with sulfur-containing substituents 先正达参股股份有限公司 2020-07-07 — — CN disclosed
US-20200055850-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-02-20 — — US disclosed
US-20200055850-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-02-20 — — US disclosed
US-10435401-B2 Pesticidally active tetracyclic derivatives with sulphur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2019-10-08 — — US disclosed
US-10435401-B2 Pesticidally active tetracyclic derivatives with sulphur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2019-10-08 — — US disclosed
EP-3194394-B1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-01-09 — — EP disclosed
EP-3194394-B1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-01-09 — — EP disclosed
US-20170260182-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2017-09-14 — — US disclosed
US-20170260182-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2017-09-14 — — US disclosed
US-20170260182-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2017-09-14 — — US disclosed
EP-3194394-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS Syngenta Participations AG (CH) 2017-07-26 — — EP disclosed
WO-2016041819-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2016-03-24 — — WO disclosed
WO-2016041819-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2016-03-24 — — 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 (3 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-20170260182-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS DDT, ACHE, GSTO1 POLB 4168/4885TRPM8 640/4885DDR1 4051/4885
US-20200055850-A1 PESTICIDALLY ACTIVE TETRACYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS DDT, ACHE, GSTM1 POLB 4099/4885TRPM8 710/4885DDR1 4290/4885
US-10435401-B2 Pesticidally active tetracyclic derivatives with sulphur containing substituents DDT, ACHE, GSTO1 POLB 4168/4885TRPM8 640/4885DDR1 4051/4885

“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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