SCHEMBL9707057

SCHEMBL9707057

C[C@H](Cc1ccc(OC(C)(C)C(=O)Cl)cc1)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.50
CNR2 P34972 7/20 0.50
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PPARA Q07869 5/20 0.49
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43

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
SCHEMBL9303566 0.91 PPARA (0.56) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707086 0.91 PPARA (0.56) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707053 0.91 ALDH1A1 (0.48) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707068 0.90 CNR1 (0.49) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707064 0.90 CNR1 (0.49) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707015 0.90 CNR1 (0.49) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707056 0.88 CNR1 (0.47) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707049 0.88 CNR1 (0.47) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707084 0.87 PPARA (0.61) CNR1CNR2POLBTDP1PPARA
SCHEMBL9707083 0.87 PPARA (0.61) CNR1CNR2POLBTDP1PPARA

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-0502498-A1 Phenoxyalkanoic acid derivatives and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1992-09-09 EP disclosed