SCHEMBL8973253

SCHEMBL8973253

O=Cc1ccccc1SO

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
THRB P10828 1/20 0.55
BLM P54132 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
TRIM24 O15164 2/20 0.50
TRIM33 Q9UPN9 2/20 0.50
ALDH1A1 P00352 3/20 0.44
TSHR P16473 1/20 0.44
ERN1 O75460 4/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SRC P12931 1/20 0.39
GAA P10253 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
TLR2 O60603 1/20 0.35
TLR1 Q15399 1/20 0.35
TLR6 Q9Y2C9 1/20 0.35

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
SCHEMBL3196146 0.80 KMT2A (0.60) LMNAKMT2AMEN1THRBBLM
SCHEMBL173014 0.76 LMNA (0.55) LMNAKMT2AMEN1THRBBLM
SCHEMBL18627019 0.76 LMNA (0.55) LMNAKMT2AMEN1THRBBLM
SCHEMBL29517618 0.76 LMNA (0.55) LMNAKMT2AMEN1THRBBLM
SCHEMBL13893056 0.76 LMNA (0.55) LMNAKMT2AMEN1THRBBLM
SCHEMBL9732046 0.76 LMNA (0.55) LMNAKMT2AMEN1THRBBLM
SCHEMBL5644348 0.76 ALOX5 (0.32) LMNAKMT2AMEN1THRBBLM
SCHEMBL9711964 0.76 LMNA (0.48) LMNAKMT2AMEN1THRBBLM
SCHEMBL9711982 0.76 LMNA (0.48) LMNAKMT2AMEN1THRBBLM
SCHEMBL18685585 0.76 APOBEC3G (0.41) LMNAKMT2AMEN1BLMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1113361-A None JP disclosed
US-5493057-A INTERMEDIATES FOR REACTIVE DYES BASF AKTIENGESELLSCHAFT (DE) 1996-02-20 US disclosed
JP-H01113361-A OXYETHYL MERCAPTO-BENZALDEHYDE AND PREPARATION OF OXIDATION PRODUCT OF THE SAME HOECHST AG 1989-05-02 JP disclosed