SCHEMBL7353607

SCHEMBL7353607

COc1ccc(S(=O)(=O)c2ccc(CN3CCC(C(=O)O)CC3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 2/20 0.58
HRH3 Q9Y5N1 2/20 0.57
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
SIGMAR1 Q99720 2/20 0.54
ALDH1A1 P00352 3/20 0.54
LMNA P02545 2/20 0.53
KDM4E B2RXH2 3/20 0.53
MMP1 P03956 2/20 0.53
MMP9 P14780 2/20 0.53
MMP13 P45452 2/20 0.53
ADAM17 P78536 2/20 0.53
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GAA P10253 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
SCHEMBL6990156 0.91 S1PR5 (0.67) S1PR5HRH3MEN1KMT2ASIGMAR1
SCHEMBL7355105 0.87 L3MBTL1 (0.51) S1PR5HRH3MEN1KMT2AALDH1A1
SCHEMBL7347681 0.86 ALDH1A1 (0.64) HRH3MEN1KMT2AALDH1A1LMNA
SCHEMBL7412160 0.84 SMN1; SMN2 (0.69) S1PR5HRH3MEN1KMT2AALDH1A1
SCHEMBL6567555 0.82 MEN1 (0.54) MEN1KMT2ASIGMAR1ALDH1A1LMNA
SCHEMBL6566644 0.80 MMP2 (0.47) MEN1KMT2ASIGMAR1ALDH1A1LMNA
SCHEMBL493434 0.79 MEN1 (0.61) MEN1KMT2ASIGMAR1ALDH1A1KDM4E
SCHEMBL8315477 0.79 ALDH1A1 (0.51) MEN1KMT2ASIGMAR1ALDH1A1LMNA
SCHEMBL7956096 0.78 MMP1 (0.55) HRH3MEN1KMT2ASIGMAR1ALDH1A1
SCHEMBL7841889 0.78 SIGMAR1 (0.65) HRH3SIGMAR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054858-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED-ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-11-29 EP disclosed
EP-0973512-A1 N-HYDROXY-2-(ALKYL, ARYL OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-01-26 EP disclosed
EP-0970046-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-01-12 EP disclosed
WO-1999042436-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED-ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1999-08-26 WO disclosed
WO-1998038163-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-09-03 WO disclosed
WO-1998037877-A1 N-HYDROXY-2-(ALKYL, ARYL OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-09-03 WO disclosed