SCHEMBL24572591

SCHEMBL24572591

CC(F)(F)c1nnc(-c2[nH]c3c(C#N)c(Cl)ccc3c2-c2cn[nH]c2)[nH]1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.32
▸ NPBWR1 P48145 1/20 0.31
▸ FLT3 P36888 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
SCHEMBL24573635 0.92 NPBWR1 (0.34) PDE10ANPBWR1FLT3
SCHEMBL29735094 0.92 NPBWR1 (0.34) PDE10ANPBWR1FLT3
SCHEMBL24573254 0.80 RXRA (0.32) —
SCHEMBL24573636 0.79 NPBWR1 (0.35) PDE10ANPBWR1FLT3
SCHEMBL29735020 0.79 NPBWR1 (0.35) PDE10ANPBWR1FLT3
SCHEMBL24573369 0.79 NPBWR1 (0.36) NPBWR1
SCHEMBL30248872 0.78 NPBWR1 (0.36) NPBWR1
SCHEMBL24572592 0.78 NPBWR1 (0.36) NPBWR1
SCHEMBL24572593 0.78 NPBWR1 (0.34) NPBWR1
SCHEMBL29735025 0.78 NPBWR1 (0.34) NPBWR1

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
WO-2022137085-A1 INDOLE DERIVATIVES USEFUL IN TREATING CONDITIONS ASSOCIATED WITH CGAS NOVARTIS AG (CH) 2022-06-30 — — WO disclosed
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