SCHEMBL25027261

SCHEMBL25027261

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 15/20 0.42
SMN1; SMN2 Q16637 5/20 0.39
THRB P10828 2/20 0.39
TP53 P04637 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 2/20 0.38
GLA P06280 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL30248593 1.00 MAPT (0.42) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL25027265 0.93 MAPT (0.42) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL30248568 0.93 MAPT (0.42) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL30248482 0.91 MAPT (0.42) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL25027263 0.91 MAPT (0.42) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL25028037 0.91 MAPT (0.44) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL30248543 0.91 MAPT (0.44) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL30248681 0.91 MAPT (0.44) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL30248507 0.91 MAPT (0.44) MAPTSMN1; SMN2THRBTP53ALDH1A1
SCHEMBL29226901 0.89 MAPT (0.45) MAPTSMN1; SMN2THRBTP53ALDH1A1

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