SCHEMBL28619945

SCHEMBL28619945

CCOC(=O)NCS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.57
TDP1 Q9NUW8 3/20 0.57
TP53 P04637 1/20 0.57
MAPT P10636 5/20 0.56
ADAM17 P78536 1/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
CYP3A4 P08684 1/20 0.56
LMNA P02545 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.54
RECQL P46063 1/20 0.54
HSD17B10 Q99714 1/20 0.54
KMT2A Q03164 3/20 0.51
HPGD P15428 1/20 0.51
GAA P10253 3/20 0.50
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
ALOX12 P18054 2/20 0.46

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
SCHEMBL28921679 0.88 CYP1A2 (0.47) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL28632298 0.88 NHERF1 (0.49) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL11304141 0.87 MAPT (0.57) ALDH1A1TDP1TP53MAPTCYP2C9
SCHEMBL19566057 0.83 LMNA (0.62) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL13201475 0.81 ALDH1A1 (0.55) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL11325997 0.81 ALDH1A1 (0.71) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL6752911 0.81 ALDH1A1 (0.66) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL28626413 0.80 GAA (0.65) ALDH1A1TDP1TP53KMT2AHPGD
SCHEMBL13686173 0.77 ALDH1A1 (0.60) ALDH1A1TDP1TP53MAPTADAM17
SCHEMBL5931062 0.77 LMNA (0.64) ALDH1A1TDP1CYP2C9LMNASMN1; SMN2

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-113336682-B Synthesis method of sulfonyl carbamate 苏州华道生物药业股份有限公司 2021-11-02 CN disclosed
CN-113336682-A Synthesis method of sulfonyl carbamate 苏州华道生物药业股份有限公司 2021-09-03 CN disclosed