SCHEMBL9765313

SCHEMBL9765313

CC(Cc1ccc([O])cc1)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.52
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
MMP2 P08253 5/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CA2 P00918 3/20 0.47
CA1 P00915 2/20 0.47
CA12 O43570 2/20 0.45

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
SCHEMBL9513690 0.87 NR3C1 (0.51) NR3C1CNR1CNR2HDAC3HDAC4
SCHEMBL9707042 0.87 NR3C1 (0.51) NR3C1CNR1CNR2HDAC3HDAC4
SCHEMBL10448359 0.87 NR3C1 (0.51) NR3C1CNR1CNR2HDAC3HDAC4
SCHEMBL9765312 0.82 ACACB (0.58) NR3C1MMP2MMP1MMP3MMP7
SCHEMBL10476890 0.81 EGFR (0.51) NR3C1HDAC3HDAC4HDAC1HDAC7
SCHEMBL7431510 0.80 HPN (0.50) NPSR1
SCHEMBL9510759 0.79 POLB (0.47) NR3C1HDAC3HDAC4HDAC1HDAC7
SCHEMBL9510498 0.79 ADRB2 (0.52) MMP2ADAMTS5NPSR1MMP1MMP3
SCHEMBL5187405 0.78 ACACB (0.55) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL12204092 0.78 ACACB (0.55) CNR1CNR2HDAC3HDAC4HDAC1

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-0255728-B1 PHENOXYACETIC ACID COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITION AND USE TANABE SEIYAKU CO., LTD. (JP) 1991-11-27 EP claimed