SCHEMBL29909005

SCHEMBL29909005

Cc1ccc(-c2cccc(N(C)c3nc4nncn4c4cc(N)ccc34)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
ALDH1A1 P00352 3/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
DHODH Q02127 1/20 0.32
IRAK4 Q9NWZ3 2/20 0.32
LRRK2 Q5S007 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
TP53 P04637 2/20 0.31
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 2/20 0.31
HPGD P15428 2/20 0.31
RAB9A P51151 2/20 0.31
GFER P55789 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
EGFR P00533 1/20 0.31
PKM P14618 1/20 0.31
PDE5A O76074 2/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 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
SCHEMBL23576893 1.00 MAPT (0.33) MAPTALDH1A1TSHRMAPK1DHODH
SCHEMBL23577063 0.93 ABCG2 (0.38) ALDH1A1TSHRMAPK1DHODHABCG2
SCHEMBL29909869 0.93 ABCG2 (0.38) ALDH1A1TSHRMAPK1DHODHABCG2
SCHEMBL29909160 0.91 ABCG2 (0.38) MAPTDHODHLRRK2ABCG2TP53
SCHEMBL23577162 0.91 ABCG2 (0.38) MAPTDHODHLRRK2ABCG2TP53
SCHEMBL23576965 0.89 TP53 (0.37) MAPTALDH1A1TP53NPC1HPGD
SCHEMBL29909323 0.89 TP53 (0.37) MAPTALDH1A1TP53NPC1HPGD
SCHEMBL23576865 0.88 MAPT (0.33) MAPTALDH1A1TSHRMAPK1DHODH
SCHEMBL23577190 0.88 MAT2A (0.37) MAPTALDH1A1TP53KDM4ENPC1
SCHEMBL29909135 0.88 MAT2A (0.37) MAPTALDH1A1TP53KDM4ENPC1

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-4445902-A2 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2024-10-16 EP disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed