SCHEMBL22859614

SCHEMBL22859614

COC(=O)c1ccc(SC)c(C)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
RAB9A P51151 3/20 0.43
MAPT P10636 3/20 0.43
NPC1 O15118 2/20 0.43
TSHR P16473 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ABL1 P00519 1/20 0.42
RXFP1 Q9HBX9 1/20 0.40
PDK2 Q15119 2/20 0.39
PDK4 Q16654 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39

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
SCHEMBL28974036 0.84 L3MBTL1 (0.46) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL30230209 0.82 L3MBTL1 (0.42) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL8491916 0.81 L3MBTL1 (0.44) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL4028749 0.81 SMN1; SMN2 (0.36) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL32668958 0.81 SMN1; SMN2 (0.36) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL4243790 0.79 PTGS2 (0.48) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL29800289 0.79 PTGS2 (0.48) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL523584 0.78 ABL1 (0.57) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL8491889 0.77 TSHR (0.47) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1
SCHEMBL7155974 0.77 PTGER4 (0.49) SMN1; SMN2L3MBTL1RAB9AMAPTNPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116375614-A Synthesis method of cyclosulfamide intermediate 江西扬帆新材料有限公司 2023-07-04 CN claimed
CN-116375614-A Synthesis method of cyclosulfamide intermediate 江西扬帆新材料有限公司 2023-07-04 CN disclosed
CN-116375614-A Synthesis method of cyclosulfamide intermediate 江西扬帆新材料有限公司 2023-07-04 CN disclosed
WO-2021036845-A1 SUBSTITUTED BENZOYL COMPOUND AND APPLICATION THEREOF 东莞市东阳光农药研发有限公司 2021-03-04 WO disclosed
WO-2021000736-A1 SUBSTITUTED BENZOYL-PYRAZOLE COMPOUND, AND APPLICATION THEREOF IN AGRICULTURE 东莞市东阳光农药研发有限公司 2021-01-07 WO disclosed