SCHEMBL23956606

SCHEMBL23956606

CC[S+]([O-])c1c(-c2nc3cc(C(F)(F)F)cnc3n2C)nn2cccnc12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ STAT3 P40763 1/20 0.31
▸ STAT1 P42224 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SENP8 Q96LD8 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP6 Q9GZR1 1/20 0.31
▸ KCNQ3 O43525 1/20 0.31
▸ KCNQ2 O43526 1/20 0.31

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
SCHEMBL23956570 0.86 POLB (0.40) POLBMEN1NPC1ALDH1A1STAT3
SCHEMBL23956596 0.83 POLB (0.39) POLBMEN1NPC1ALDH1A1STAT3
SCHEMBL23956663 0.81 POLB (0.40) POLBPDE10AMEN1NPC1ALDH1A1
SCHEMBL19993256 0.80 POLB (0.41) POLBPDE10AALDH1A1RAB9AKCNQ3
SCHEMBL29431642 0.80 POLB (0.42) POLBPDE10ANPC1ALDH1A1CASP3
SCHEMBL14684622 0.80 POLB (0.42) POLBPDE10ANPC1ALDH1A1CASP3
SCHEMBL23956549 0.79 POLB (0.37) POLBMEN1NPC1ALDH1A1STAT3
SCHEMBL16612441 0.78 POLB (0.44) POLBMEN1NPC1ALDH1A1STAT3
SCHEMBL16612300 0.77 POLB (0.42) POLBPDE10AALDH1A1RAB9A
SCHEMBL24044914 0.76 POLB (0.38) POLB

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-3515921-B1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-10-27 — — EP disclosed
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