SCHEMBL19453383

SCHEMBL19453383

CCc1c(C)nc(SC)nc1C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ HTT P42858 2/20 0.35
▸ KDM4E B2RXH2 4/20 0.33
▸ MAPT P10636 3/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ABCB1 P08183 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ KDM5B Q9UGL1 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
SCHEMBL12661856 0.85 L3MBTL1 (0.38) PKMLMNAL3MBTL1HSP90AB1HTT
SCHEMBL22011296 0.85 KDM4E (0.35) PKMLMNAL3MBTL1HSP90AB1HTT
SCHEMBL23094652 0.78 LMNA (0.37) PKMLMNAL3MBTL1HSP90AB1HTT
SCHEMBL18304964 0.78 KMT2A (0.38) PKMLMNAL3MBTL1HSP90AB1HTT
SCHEMBL12705664 0.77 HSP90AB1 (0.34) HSP90AB1HTT
SCHEMBL12661853 0.73 L3MBTL1 (0.42) LMNAL3MBTL1HSP90AB1HTTMAPT
SCHEMBL15904085 0.73 HSP90AB1 (0.41) HSP90AB1ABCB1GAAKMT2A
SCHEMBL8513029 0.73 LMNA (0.38) PKMLMNAL3MBTL1HSP90AB1HTT
SCHEMBL26660089 0.73 KDM4E (0.34) PKMLMNAL3MBTL1HSP90AB1HTT
SCHEMBL16189021 0.73 TLR8 (0.35) LMNAKDM4EMAPTMAPK1ALDH1A1

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-2017176812-A1 cGAS ANTAGONIST COMPOUNDS IMMUNE SENSOR, LLC (US) 2017-10-12 — — WO disclosed
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