SCHEMBL17858043

SCHEMBL17858043

CCS(=O)(=O)c1cc(C2CCC2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.41
▸ BRD4 O60885 1/20 0.32
▸ PPARD Q03181 1/20 0.32
▸ RORC P51449 2/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ MCHR1 Q99705 1/20 0.32
▸ DRD2 P14416 2/20 0.31
▸ DRD4 P21917 2/20 0.31
▸ GRM2 Q14416 2/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ PDE2A O00408 3/20 0.31
▸ PDE10A Q9Y233 3/20 0.31
▸ SSTR4 P31391 1/20 0.31
▸ CHRNA7 P36544 1/20 0.31
▸ DDR1 Q08345 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
SCHEMBL17858050 0.98 POLB (0.41) POLBBRD4PPARDLRRK2MCHR1
SCHEMBL17858055 0.97 POLB (0.41) POLBBRD4PPARDLRRK2MCHR1
SCHEMBL17844030 0.96 POLB (0.43) POLBBRD4RORCLRRK2MCHR1
SCHEMBL30711169 0.96 POLB (0.43) POLBBRD4RORCLRRK2MCHR1
SCHEMBL17609374 0.93 POLB (0.40) POLBBRD4RORCLRRK2MCHR1
SCHEMBL29360277 0.88 POLB (0.48) POLBLRRK2DDR1
SCHEMBL14684583 0.88 POLB (0.48) POLBLRRK2DDR1
SCHEMBL25184184 0.87 POLB (0.41) POLBBRD4RORCMCHR1DRD2
SCHEMBL30989728 0.87 POLB (0.39) POLBPPARDMCHR1DRD2DRD4
SCHEMBL25885629 0.87 POLB (0.39) POLBPPARDMCHR1DRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317119-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2021-10-14 — — US disclosed
US-11072608-B2 Pesticidally active heterocyclic derivatives with sulphur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2021-07-27 — — US disclosed
US-20190308971-A1 PESTICIDALLY ACTIVE HETROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-10-10 — — US disclosed
US-10323030-B2 Pesticidally active heterocyclic derivatives with sulphur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2019-06-18 — — US disclosed
US-20170342065-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2017-11-30 — — US disclosed
US-20170342065-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2017-11-30 — — US disclosed
WO-2016096584-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2016-06-23 — — 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 (5 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-11072608-B2 Pesticidally active heterocyclic derivatives with sulphur containing substituents DDT, ACHE, GSTM1 POLB 4235/4885BRD4 4213/4885PPARD 1540/4885
US-20210317119-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS DDT, ACHE, GSTM1 POLB 4395/4885BRD4 3879/4885PPARD 1176/4885
US-10323030-B2 Pesticidally active heterocyclic derivatives with sulphur containing substituents DDT, ACHE, GSTM1 POLB 4378/4885BRD4 4235/4885PPARD 1120/4885
US-20170342065-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS DDT, ACHE, GSTM1 POLB 4325/4885BRD4 4054/4885PPARD 1319/4885
US-20190308971-A1 PESTICIDALLY ACTIVE HETROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS DDT, GSTO1, GSTM1 POLB 4410/4885BRD4 4654/4885PPARD 1481/4885

“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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