SCHEMBL30895175

SCHEMBL30895175

ClCc1ccc2c(c1)N(Cc1ccccc1)CCS2

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.59
KDM4E B2RXH2 7/20 0.59
ALDH1A1 P00352 4/20 0.59
HPGD P15428 3/20 0.59
TP53 P04637 5/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
GFER P55789 4/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
GLA P06280 2/20 0.52
GAA P10253 1/20 0.52
HSD17B10 Q99714 1/20 0.52
HDAC1 Q13547 1/20 0.51
HDAC6 Q9UBN7 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
SCHEMBL29226875 0.89 MAPT (0.60) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL30248720 0.89 MAPT (0.57) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL30895157 0.84 MAPT (0.58) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL23769111 0.84 MAPT (0.58) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL29226906 0.83 MAPT (0.59) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL29226930 0.82 MAPT (0.59) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL23769038 0.81 MAPT (0.74) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL21905570 0.76 MAPT (0.68) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL23769051 0.75 MAPT (0.64) MAPTKDM4EALDH1A1HPGDTP53
SCHEMBL29978899 0.75 MAPT (0.64) MAPTKDM4EALDH1A1HPGDTP53

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 1 patent. 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 disclosed