SCHEMBL29909526

SCHEMBL29909526

CN(c1cccc(-c2cccc(C(C)(C)C)c2)c1)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
OPRD1 P41143 2/20 0.34
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
CCR9 P51686 1/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
MAT2A P31153 6/20 0.33
KIF11 P52732 1/20 0.33
PRMT5 O14744 2/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 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
SCHEMBL23577383 1.00 FNTA (0.39) FNTAFNTBOPRD1OPRM1OPRK1
SCHEMBL29909922 0.93 FNTA (0.41) FNTAFNTBOPRD1CCR9TP53
SCHEMBL23577059 0.93 FNTA (0.41) FNTAFNTBOPRD1CCR9TP53
SCHEMBL23601421 0.90 FNTA (0.39) FNTAFNTBTP53MAPTMAT2A
SCHEMBL29909732 0.90 FNTA (0.39) FNTAFNTBTP53MAPTMAT2A
SCHEMBL23576841 0.90 FNTA (0.39) FNTAFNTBTP53MAPTMAT2A
SCHEMBL30920925 0.89 TP53 (0.39) FNTAFNTBTP53MAPTMAT2A
SCHEMBL23601235 0.89 FNTA (0.40) FNTAFNTBTP53MAPTMAT2A
SCHEMBL29909768 0.89 FNTA (0.40) FNTAFNTBTP53MAPTMAT2A
SCHEMBL23601743 0.89 FNTA (0.39) FNTAFNTBTP53MAPTMAT2A

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-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed