SCHEMBL25027262

SCHEMBL25027262

O=C(Nc1ccc2cc[nH]c2c1)NC(CC(=O)N1CCCC1)c1ccc2c(c1)N(Cc1ccccc1)CCS2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.47
KDM4E B2RXH2 7/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 3/20 0.47
GFER P55789 4/20 0.41
GLA P06280 2/20 0.39
SMN1; SMN2 Q16637 6/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TP53 P04637 4/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FAAH O00519 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL30248547 1.00 MAPT (0.47) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL25027269 0.94 KDM4E (0.44) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL30248710 0.94 KDM4E (0.44) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL29227209 0.93 MAPT (0.48) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL30248575 0.90 MAPT (0.46) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL25028045 0.90 MAPT (0.46) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL25027268 0.90 MAPT (0.41) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL30248670 0.90 MAPT (0.41) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL25028042 0.90 MAPT (0.48) MAPTKDM4EALDH1A1HPGDGFER
SCHEMBL29227011 0.90 MAPT (0.48) MAPTKDM4EALDH1A1HPGDGFER

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-118019738-A Small molecule urea derivatives as STING antagonists 库拉德夫制药私人有限公司 2024-05-10 CN claimed
WO-2023017452-A1 SMALL MOLECULE UREA DERIVATIVES AS STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2023-02-16 WO disclosed