SCHEMBL10465415

SCHEMBL10465415

CC(C)(C)c1cc(NC=S)c(O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.40
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.39
ALOX5 P09917 3/20 0.39
PTGS2 P35354 3/20 0.39
GAA P10253 3/20 0.39
NR5A2 O00482 1/20 0.38
NR5A1 Q13285 1/20 0.38
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38
CYP1A2 P05177 5/20 0.38
CYP2C9 P11712 4/20 0.38
CYP2C19 P33261 4/20 0.38
CYP3A4 P08684 3/20 0.38
TSHR P16473 3/20 0.38
MAPT P10636 4/20 0.38
ALOX15 P16050 4/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL23793643 0.80 CA2 (0.46) HSP90AA1CA2CA1ALOX5PTGS2
SCHEMBL10467416 0.78 ALDH1A1 (0.52) CA2CA1PTGS2GAAALDH1A1
SCHEMBL394716 0.78 CA2 (0.45) HSP90AA1CA2CA1ALOX5PTGS2
SCHEMBL11686726 0.77 CA2 (0.43) HSP90AA1CA2CA1ALOX5PTGS2
SCHEMBL10465414 0.76 HSP90AA1 (0.40) HSP90AA1CA2CA1ALOX5PTGS2
SCHEMBL35141 0.74 CA2 (0.67) HSP90AA1CA2CA1GAAALDH1A1
SCHEMBL18593372 0.74 CYP1A2 (0.42) HSP90AA1CA2CA1ALOX5PTGS2
SCHEMBL29416834 0.73 CA2 (0.52) HSP90AA1CA2CA1GAANR5A2
SCHEMBL247483 0.73 CA2 (0.52) HSP90AA1CA2CA1GAANR5A2
SCHEMBL27560100 0.72 ALDH1A1 (0.46) HSP90AA1CA2CA1ALOX5PTGS2

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
US-4933355-A ALDOSE REDUCTASE INHIBITORS SANKYO COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0337819-A1 Thiazole derivatives, their preparation and their use in the treatment of diabetes complications Sankyo Company Limited (JP) 1989-10-18 EP disclosed