SCHEMBL6606296

SCHEMBL6606296

CC(C)CC(NO)S(=O)(=O)Cc1cnc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.48
MMP9 P14780 2/20 0.48
MMP8 P22894 1/20 0.48
CYP1A2 P05177 1/20 0.45
MMP13 P45452 1/20 0.44
CCR1 P32246 2/20 0.41
ACACB O00763 1/20 0.40
MMP1 P03956 1/20 0.40
FCER2 P06734 1/20 0.40
MMP3 P08254 1/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KMT2A Q03164 1/20 0.40
GCG P01275 1/20 0.40
ACP1 P24666 1/20 0.40
GRN P28799 1/20 0.40
SORT1 Q99523 1/20 0.40
RAB9A P51151 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 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
SCHEMBL6608485 0.89 MMP2 (0.48) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6079755 0.89 KMT2A (0.42) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6607281 0.86 CYP1A2 (0.45) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6611582 0.84 TRPV1 (0.45) MMP2MMP9CYP1A2MMP13MMP1
SCHEMBL6608602 0.83 KDM4E (0.43) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6608479 0.81 MMP2 (0.45) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6608483 0.81 MMP2 (0.45) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6989873 0.79 KMT2A (0.44) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6399019 0.78 MMP2 (0.42) MMP2MMP9MMP8CYP1A2MMP13
SCHEMBL6987795 0.77 CYP1A2 (0.43) MMP2MMP9MMP8CYP1A2MMP13

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-1289980-B1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP disclosed