Benzaldehyde

Benzaldehyde

SCHEMBL4950072

O=Cc1ccccc1.O=Cc1ccccc1S(=O)(=O)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
CYP2A6 P11509 1/20 0.52
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
THRB P10828 1/20 0.43
BLM P54132 1/20 0.43
PPARG P37231 1/20 0.42
TRIM24 O15164 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTT P42858 1/20 0.38
MYC P01106 1/20 0.36
KDM4E B2RXH2 1/20 0.35
UNG P13051 1/20 0.35
GAA P10253 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
TTR P02766 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
SCHEMBL29563815 0.90 TDP1 (0.52) ALDH1A1KMT2ATDP1LMNAMEN1
SCHEMBL40458 0.90 TDP1 (0.52) ALDH1A1KMT2ATDP1LMNAMEN1
SCHEMBL1302666 0.88 TDP1 (0.50) ALDH1A1KMT2ATDP1LMNAMEN1
Water SCHEMBL8176347 0.88 TDP1 (0.50) ALDH1A1KMT2ATDP1LMNAMEN1
SCHEMBL30293806 0.88 TDP1 (0.50) ALDH1A1KMT2ATDP1LMNAMEN1
SCHEMBL549939 0.88 TDP1 (0.50) ALDH1A1KMT2ATDP1LMNAMEN1
SCHEMBL2986619 0.88 TDP1 (0.50) ALDH1A1KMT2ATDP1LMNAMEN1
SCHEMBL27216027 0.87 ALDH1A1 (0.58) ALDH1A1CYP2A6KMT2AMEN1PPARG
Water SCHEMBL1403479 0.86 TDP1 (0.48) ALDH1A1KMT2ATDP1LMNAMEN1
Phenol SCHEMBL2331803 0.85 TRIM24 (0.45) ALDH1A1KMT2ATDP1LMNAMEN1

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-1975433-A2 Rolling bearing JTEKT Corporation (JP) 2008-10-01 EP disclosed