SCHEMBL29909416

SCHEMBL29909416

COc1ccc(-c2nccc(N(C)c3nc4nnc(Cl)n4c4ccccc34)n2)cn1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.36
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
KMT2A Q03164 1/20 0.31
KDR P35968 1/20 0.31
OXTR P30559 1/20 0.31
EPHB4 P54760 1/20 0.31
GRM5 P41594 1/20 0.31
F2RL3 Q96RI0 2/20 0.31
TNF P01375 1/20 0.31
DYRK1A Q13627 1/20 0.30
FFAR2 O15552 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
SCHEMBL29909093 0.86
SCHEMBL29909640 0.84 KDM1A (0.34) KDM1AKDROXTREPHB4GRM5
SCHEMBL29909361 0.81 HSD17B1 (0.39) KDM1AKDROXTREPHB4
SCHEMBL23601042 0.78 ACLY (0.36) KMT2AKDREPHB4
SCHEMBL29909482 0.76
SCHEMBL29909512 0.73 BMX (0.36) MEN1KMT2ADYRK1A
SCHEMBL29909836 0.72 GRIN2B (0.33)
SCHEMBL29909741 0.70 NPC1 (0.43)
SCHEMBL30979130 0.70
SCHEMBL29909353 0.69 ABCG2 (0.37) DYRK1A

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