SCHEMBL18179621

SCHEMBL18179621

CCS(=O)(=O)c1cc(-n2ccc(C(F)(F)F)n2)sc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.35
▸ IDH1 O75874 2/20 0.32
▸ IDH2 P48735 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.30
▸ LMNA P02545 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
SCHEMBL18179617 0.85 PRMT6 (0.34) PRMT6IDH1IDH2PDE10A
SCHEMBL21375980 0.83 PRMT6 (0.35) PRMT6IDH1IDH2PDE10A
SCHEMBL21376195 0.82 PRMT6 (0.34) PRMT6IDH1IDH2
SCHEMBL18173807 0.82 SDHB (0.32) —
SCHEMBL18179710 0.81 PRMT6 (0.34) PRMT6IDH1IDH2PDE10A
SCHEMBL17696232 0.79 NPC1 (0.33) PRMT6IDH1IDH2PDE10A
SCHEMBL18179727 0.78 PTGS2 (0.36) LMNA
SCHEMBL22030839 0.76 PRMT6 (0.31) PRMT6
SCHEMBL17466031 0.74 DDR1 (0.37) —
SCHEMBL19299805 0.73 LMNA (0.33) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286187-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2019-09-18 — — EP disclosed
US-20180099970-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2018-04-12 — — US disclosed
US-20180099970-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2018-04-12 — — US disclosed
WO-2016169886-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES SYNGENTA CROP PROTECTION AG (CH) 2016-10-27 — — 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 (1 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-20180099970-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES DDT, NIT2, SQOR PRMT6 1768/4885IDH1 263/4885IDH2 309/4885

“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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