SCHEMBL6976767

SCHEMBL6976767

O=C(O)OC1(CS(=O)(=O)CCCOc2ccc(Cl)cc2)CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.45
▸ MMP1 P03956 4/20 0.41
▸ MMP13 P45452 4/20 0.41
▸ MMP9 P14780 3/20 0.41
▸ MMP2 P08253 3/20 0.41
▸ MMP8 P22894 3/20 0.41
▸ ADAM17 P78536 2/20 0.41
▸ ABCB11 O95342 2/20 0.41
▸ MMP3 P08254 2/20 0.41
▸ MMP7 P09237 2/20 0.41
▸ MMP14 P50281 2/20 0.41
▸ MMP10 P09238 1/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ MAPK1 P28482 2/20 0.39
▸ HRH3 Q9Y5N1 6/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CPT1A P50416 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6969747 0.89 MMP13 (0.50) MMP1MMP13MMP9MMP2MMP8
SCHEMBL6735645 0.84 MMP1 (0.47) USP2MMP1MMP13MMP9MMP2
SCHEMBL6976704 0.81 MMP1 (0.40) MMP1MMP13EPHX2
SCHEMBL6953375 0.81 SMN1; SMN2 (0.46) USP2MMP1MMP13MMP9MMP2
SCHEMBL6727302 0.79 MMP13 (0.64) USP2MMP1MMP13MMP9MMP2
SCHEMBL6976225 0.78 MMP13 (0.45) MMP1MMP13MMP9MMP2MMP8
SCHEMBL6735054 0.73 MMP13 (0.52) MMP1MMP13MMP9MMP2MMP8
SCHEMBL6727259 0.72 MMP1 (0.43) MMP1MMP13MMP9MMP2MMP8
SCHEMBL6952614 0.72 MMP13 (0.52) MMP1MMP13MMP9MMP2MMP8
SCHEMBL6827826 0.70 CYP4F2 (0.43) MMP1MMP13MMP9MMP2MMP8

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
EP-1053233-B1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES DARWIN DISCOVERY LTD (GB) 2003-08-20 — — EP claimed
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