SCHEMBL29909468

SCHEMBL29909468

CC(=O)Nc1ccc(-c2cccc(N(C)c3nc4nncn4c4cc(Cl)ccc34)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.47
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
PLAU P00749 1/20 0.36
MOK Q9UQ07 1/20 0.36
F10 P00742 2/20 0.36
AOC3 Q16853 2/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL23576968 1.00 TP53 (0.47) TP53TDP1KDM4EMEN1ALDH1A1
SCHEMBL23576656 0.93 TP53 (0.39) TP53PLAUF10CNR1FNTA
SCHEMBL29909287 0.91 NPC1 (0.38) TP53KDM4ENPC1RAB9APLAU
SCHEMBL23576714 0.91 NPC1 (0.38) TP53KDM4ENPC1RAB9APLAU
SCHEMBL29909552 0.90 AOC3 (0.38) TP53KDM4EMEN1ALDH1A1HPGD
SCHEMBL29909015 0.90 IDO1 (0.37) TP53KDM4EMEN1ALDH1A1HPGD
SCHEMBL23577153 0.90 AOC3 (0.38) TP53KDM4EMEN1ALDH1A1HPGD
SCHEMBL23577181 0.90 IDO1 (0.37) TP53KDM4EMEN1ALDH1A1HPGD
SCHEMBL23601408 0.89 KMT2A (0.39) TP53KDM4EMEN1ALDH1A1HPGD
SCHEMBL29909110 0.89 KMT2A (0.39) TP53KDM4EMEN1ALDH1A1HPGD

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
EP-4081305-B1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES INC (JP) 2024-09-18 EP disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed