SCHEMBL29162197

SCHEMBL29162197

O=c1ncc2c(F)c(F)ccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.39
PDE7A Q13946 1/20 0.34
KDM4E B2RXH2 3/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 1/20 0.33
CASP1 P29466 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PARP1 P09874 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
ACHE P22303 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
PDE3B Q13370 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
SCHEMBL8623931 0.78 DAO (0.49) DAOKDM4EKMT2AHSD17B10PARP1
SCHEMBL30095711 0.78 DAO (0.49) DAOKDM4EKMT2AHSD17B10PARP1
SCHEMBL7215930 0.70 MEN1 (0.35) KDM4EKMT2AHSD17B10MEN1CASP1
SCHEMBL3171494 0.70 KDM4E (0.33) DAOKDM4EKMT2AMEN1PARP1
SCHEMBL1287813 0.69 KDM4E (0.46) KDM4EKMT2AHSD17B10MEN1CASP1
SCHEMBL31411470 0.68 TRPA1 (0.50) HPGDHTTMETAP2
SCHEMBL31184676 0.68 DAO (0.38) DAOKDM4EALDH1A1HPGDPDE3B
SCHEMBL31184602 0.68 LMNA (0.37) DAOPARP1ALDH1A1HPGDPDE3B
SCHEMBL31184823 0.68 ALDH1A1 (0.39) KDM4EHSD17B10PARP1ALDH1A1HPGD
SCHEMBL30424493 0.68 KDM4E (0.35) DAOKDM4EKMT2AHSD17B10MEN1

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
EP-4359389-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-05-01 EP disclosed
CN-117480155-A Diacylglycerol kinase modulating compounds 吉利德科学公司 2024-01-30 CN disclosed
WO-2022271677-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed