SCHEMBL29909480

SCHEMBL29909480

C#CC(C)(O)Cc1cccc(N(CC)c2nc3nncn3c3cc(Cl)ccc23)c1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
TP53 P04637 3/20 0.34
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PRMT5 O14744 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAT2A P31153 1/20 0.32
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL29909515 0.90 MAPT (0.33) MAPTTP53FNTAFNTBPRMT5
SCHEMBL23577465 0.82 PTGES (0.35) MAPTTP53FNTAFNTBPRMT5
SCHEMBL29909653 0.80 SMN1; SMN2 (0.31) MAPTMAT2ASMN1; SMN2
SCHEMBL29909800 0.80 MAT2A (0.32) MAPTTP53FNTAFNTBPRMT5
SCHEMBL23577387 0.80 MAT2A (0.36) MAPTTP53FNTAFNTBPRMT5
SCHEMBL29909567 0.80 MAT2A (0.36) MAPTTP53FNTAFNTBPRMT5
SCHEMBL29909281 0.79 MAT2A (0.31) MAT2A
SCHEMBL29909372 0.79 MAT2A (0.31) MAT2A
SCHEMBL29909947 0.78
SCHEMBL29909979 0.77 PAK4 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed