SCHEMBL6990550

SCHEMBL6990550

COC(C(C)N(C=O)OC(C)(C)C)S(=O)(=O)Cc1cnc2ccccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.38
EPAS1 Q99814 1/20 0.38
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TRPM5 Q9NZQ8 1/20 0.35
PDE10A Q9Y233 4/20 0.35
CYP1A2 P05177 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
PTGES O14684 1/20 0.33

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
SCHEMBL6988576 0.85 KDM4E (0.41) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6662759 0.85 HIF1A (0.36) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6077244 0.81 HIF1A (0.36) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6987551 0.80 PDE10A (0.35) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6985491 0.80 HIF1A (0.36) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6661883 0.79 PDE10A (0.35) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6399798 0.78 HIF1A (0.37) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6606815 0.78 PDE10A (0.36) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6982449 0.78 HIF1A (0.35) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6607311 0.78 HIF1A (0.36) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289980-A1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2003-03-12 EP disclosed
WO-2001090100-A1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-29 WO disclosed