SCHEMBL6646356

SCHEMBL6646356

Cc1ccc2oc(S(=O)(=O)c3ccn[nH]c3=O)c(C)c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 6/20 0.59
KCNH2 Q12809 2/20 0.36
ALPG P10696 1/20 0.35
FGFR1 P11362 1/20 0.34
MAPT P10636 2/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.33
NQO1 P15559 1/20 0.33
MEN1 O00255 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
SCHEMBL6646151 0.88 AKR1B1 (0.60) AKR1B1KCNH2MEN1KMT2A
SCHEMBL4451947 0.74 AKR1B1 (1.00) AKR1B1
SCHEMBL30889702 0.67 KMT2A (0.46) AKR1B1ALPGMAPTHTTRAB9A
SCHEMBL6646351 0.66 AKR1B1 (0.47) AKR1B1ALPGMAPTHTTRAB9A
SCHEMBL4570872 0.64 NQO1 (0.57) KCNH2ALPGMAPTHTTRAB9A
SCHEMBL4454819 0.63 AKR1B1 (1.00) AKR1B1
SCHEMBL690925 0.63 AKR1B1 (1.00) AKR1B1
SCHEMBL27374058 0.61 HCAR2 (0.38) RAB9AALDH1A1HSD17B10NPC1
SCHEMBL6230934 0.60 NOS1 (0.62) ALPGMAPTHTTRAB9AKDM4E
SCHEMBL29655018 0.60 ALDH1A1 (0.56) MAPTHTTRAB9ACA12CA9

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-1373259-B1 PYRIDAZINONE ALDOSE REDUCTASE INHIBITORS PFIZER PROD INC (US) 2004-12-29 EP claimed