SCHEMBL29909113

SCHEMBL29909113

C[Si](C)(C)CCOCn1c(NN)nc2cc(Br)ccc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.44
KDM4E B2RXH2 4/20 0.44
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 2/20 0.41
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
CACNA2D1 P54289 1/20 0.35
DGAT1 O75907 2/20 0.35
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33

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
SCHEMBL23577034 1.00 MAPT (0.44) MAPTKDM4ENPC1ALDH1A1SMN1; SMN2
SCHEMBL29909785 0.87 KDM4E (0.44) MAPTKDM4ENPC1ALDH1A1SMN1; SMN2
SCHEMBL23577285 0.87 KDM4E (0.44) MAPTKDM4ENPC1ALDH1A1SMN1; SMN2
SCHEMBL23601086 0.84 KDM4E (0.61) MAPTKDM4ENPC1ALDH1A1SMN1; SMN2
SCHEMBL27235793 0.83 MAPT (0.41) MAPTKDM4ENPC1ALDH1A1SMN1; SMN2
SCHEMBL23576644 0.83 NPC1 (0.41) MAPTNPC1ALDH1A1GAACACNA2D1
SCHEMBL29909620 0.83 NPC1 (0.41) MAPTNPC1ALDH1A1GAACACNA2D1
SCHEMBL29991937 0.75 ATM (0.47) MAPTKDM4ENPC1ALDH1A1SMN1; SMN2
SCHEMBL38656278 0.74 KMT2A (0.41) MAPTNPC1ALDH1A1SMN1; SMN2POLB
SCHEMBL21072505 0.73 PARP14 (0.41)

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 3 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
CN-115362003-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2022-11-18 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed