SCHEMBL23643201

SCHEMBL23643201

CCc1ccc(-c2ccc(C)c(C)c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
NPC1 O15118 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CTSK P43235 1/20 0.38
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
MCL1 Q07820 1/20 0.35
PIK3CA P42336 3/20 0.35
PI4KA P42356 3/20 0.35
PI4KB Q9UBF8 3/20 0.35
PIK3CD O00329 2/20 0.35
PIK3CB P42338 2/20 0.35
PIK3CG P48736 1/20 0.35
MAP4K4 O95819 1/20 0.34
NOTUM Q6P988 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL3217142 0.84 PRMT5 (0.45) PRMT5WDR77MAPTNPC1PTGS1
SCHEMBL19311825 0.84 GRIN2B (0.47)
SCHEMBL26040044 0.84 PRMT5 (0.46) PRMT5WDR77PTGS1PTGS2S1PR1
SCHEMBL12462747 0.77 PRMT5 (0.40) PRMT5WDR77PTGS1PTGS2PIK3CA
SCHEMBL12083955 0.75 TAAR1 (0.47) PRMT5WDR77MAP4K4
SCHEMBL13495562 0.75 GRM5 (0.44) PRMT5WDR77PTGS1PTGS2PIK3CD
SCHEMBL12190331 0.75 METAP2 (0.43) PRMT5WDR77MAPTNPC1PTGS1
SCHEMBL10271458 0.75 RAB9A (0.45) PRMT5WDR77MAPTNPC1
SCHEMBL18822208 0.75 PRMT5 (0.41) PRMT5WDR77PTGS1PTGS2PIK3CA
SCHEMBL10460931 0.75 METAP2 (0.43) PRMT5WDR77MAPTNPC1PTGS1

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-3848368-A1 TROPOMYOSIN-RELATED KINASE (TRK) INHIBITORS Genzyme Corporation (US) 2021-07-14 EP disclosed