SCHEMBL7346576

SCHEMBL7346576

CCOC(=O)C1CCN(Cc2ccc(S(=O)(=O)c3ccc(OC)cc3)c(OC)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.66
ALDH1A1 P00352 5/20 0.66
MAPT P10636 1/20 0.61
POLB P06746 2/20 0.60
TDP1 Q9NUW8 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.55
CCR8 P51685 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52

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
SCHEMBL7410971 0.92 KDM4E (0.60) KDM4EALDH1A1MAPTPOLBTDP1
SCHEMBL7355105 0.88 L3MBTL1 (0.51) KDM4EALDH1A1TDP1SMN1; SMN2HRH3
SCHEMBL7347681 0.88 ALDH1A1 (0.64) KDM4EALDH1A1MAPTPOLBTDP1
SCHEMBL6988354 0.82 KDM4E (0.74) KDM4EALDH1A1MAPTPOLBTDP1
SCHEMBL7409733 0.81 S1PR5 (0.63) KDM4EALDH1A1HRH3
SCHEMBL6566748 0.80 ALDH1A1 (0.59) KDM4EALDH1A1MAPTPOLBTDP1
SCHEMBL22895271 0.80 KDM4E (0.77) KDM4EALDH1A1MAPTPOLBTDP1
SCHEMBL32670194 0.76 KDM4E (0.77) KDM4EALDH1A1MAPTPOLBTDP1
SCHEMBL7353607 0.75 S1PR5 (0.58) KDM4EALDH1A1POLBSMN1; SMN2HRH3
SCHEMBL7415473 0.75 L3MBTL1 (0.67) KDM4EALDH1A1MAPTSMN1; SMN2CCR8

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