SCHEMBL29909366

SCHEMBL29909366

NNc1nc2ccccc2c(=O)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.64
ALDH1A1 P00352 5/20 0.64
TNKS2 Q9H2K2 4/20 0.61
PARP1 P09874 3/20 0.61
QTRT1 Q9BXR0 1/20 0.61
RAB9A P51151 6/20 0.59
MAPT P10636 7/20 0.57
KMT2A Q03164 6/20 0.57
MEN1 O00255 5/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
NPC1 O15118 4/20 0.57
GLA P06280 3/20 0.57
HPGD P15428 2/20 0.57
GAA P10253 1/20 0.57
TNKS O95271 2/20 0.54
PKM P14618 1/20 0.51
POLB P06746 2/20 0.51
LMNA P02545 2/20 0.51
TP53 P04637 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL3821179 1.00 KDM4E (0.64) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL30289849 0.81 KDM4E (0.74) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL5199045 0.79 TNKS2 (0.62) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL28275368 0.79 KDM4E (0.60) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL18934419 0.79 KDM4E (0.74) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL18934416 0.77 KDM4E (0.70) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL47352 0.76 PARP1 (1.00) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL103994 0.76 QTRT1 (1.00) ALDH1A1TNKS2PARP1QTRT1MAPT
SCHEMBL6695759 0.75 TNKS2 (0.81) KDM4EALDH1A1TNKS2PARP1QTRT1
SCHEMBL11637387 0.74 KDM4E (0.69) KDM4EALDH1A1TNKS2PARP1RAB9A

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