SCHEMBL23601355

SCHEMBL23601355

CN(c1cccc(CCC(C)(O)C2CCC2)c1)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 2/20 0.32
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30
PRMT5 O14744 1/20 0.30
CYP1A2 P05177 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
SCHEMBL29909281 0.84 MAT2A (0.31) MAT2A
SCHEMBL23601401 0.83 MAPT (0.34) MAT2ATP53MAPTFNTAFNTB
SCHEMBL29909515 0.81 MAPT (0.33) MAT2ATP53MAPTFNTAFNTB
SCHEMBL24721450 0.81 MAP3K14 (0.34) MAT2AFNTAFNTB
SCHEMBL31229545 0.81 MAP3K14 (0.34) MAT2AFNTAFNTB
SCHEMBL29909800 0.81 MAT2A (0.32) MAT2ATP53MAPTFNTAFNTB
SCHEMBL24721449 0.80 MAT2A (0.31) MAT2AFNTAFNTB
SCHEMBL30979079 0.79 MAT2A (0.32) MAT2AFNTAFNTB
SCHEMBL23601415 0.77 MAT2A (0.32) MAT2AFNTAFNTB
SCHEMBL29909372 0.76 MAT2A (0.31) MAT2A

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-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 WO disclosed