SCHEMBL8701281

SCHEMBL8701281

OC(c1ccc(Cl)cc1)c1ccc2[nH]c(=S)oc2c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 11/20 0.64
KEAP1 Q14145 1/20 0.47
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 2/20 0.41
CHEK2 O96017 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HAVCR2 Q8TDQ0 1/20 0.34
HSD17B10 Q99714 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 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
SCHEMBL8697217 0.87 PSMB8 (0.50) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL8698994 0.85 PSMB8 (0.64) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL779231 0.79 PSMB8 (1.00) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL8703017 0.76 PSMB8 (0.46) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL13508871 0.74 PSMB8 (0.61) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL8701154 0.74 PSMB8 (0.43) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL8698930 0.74 PSMB8 (0.43) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL8697342 0.73 PSMB8 (0.64) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL8699552 0.73 PSMB8 (0.68) PSMB8KEAP1ALDH1A1KDM4EGAA
SCHEMBL15887349 0.71 PSMB8 (0.52) PSMB8KEAP1ALDH1A1KDM4EGAA

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
WO-1998025913-A1 NOVEL SUBSTITUTED 3H -BENZOXAZOLE-2-THIONES AND 3H -BENZOTHIAZOLE-2 THIONES DERIVATIVES, METHOD FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1998-06-18 WO disclosed