SCHEMBL19189934

SCHEMBL19189934

Cc1cncc(-c2cnc(C(F)(F)CNC(=O)c3ccccc3C(F)(F)F)c(Cl)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 2/20 0.41
▸ HCRTR2 O43614 2/20 0.41
▸ PTGES O14684 12/20 0.39
▸ TP53 P04637 1/20 0.37
▸ P2RX7 Q99572 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ KCNK3 O14649 1/20 0.37
▸ KCNK9 Q9NPC2 1/20 0.37
▸ POLB P06746 1/20 0.36

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
SCHEMBL16552229 0.90 ALDH1A1 (0.39) HCRTR1HCRTR2PTGESP2RX7LMNA
SCHEMBL16552192 0.90 P2RX7 (0.39) HCRTR1HCRTR2PTGESTP53P2RX7
SCHEMBL16665046 0.88 LMNA (0.41) PTGESP2RX7LMNAGAAKCNK3
SCHEMBL17917771 0.88 P2RX7 (0.43) HCRTR1HCRTR2PTGESP2RX7POLB
SCHEMBL17917773 0.87 P2RX7 (0.43) P2RX7LMNAGAA
SCHEMBL16654673 0.86 P2RX7 (0.44) P2RX7LMNAGAA
SCHEMBL16665062 0.86 P2RX7 (0.40) PTGESP2RX7LMNAGAAPOLB
SCHEMBL16665057 0.86 SCN9A (0.40) PTGESTP53P2RX7
SCHEMBL17991472 0.85 P2RX7 (0.41) PTGESTP53P2RX7LMNAGAA
SCHEMBL16552193 0.85 DGAT1 (0.41) PTGESTP53P2RX7LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3039018-B1 PYRIDYL CARBOXAMIDE DERIVATIVES WITH PESTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2017-08-02 — — EP disclosed
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