Benzaldehyde

Benzaldehyde

SCHEMBL28790210

NC(=O)CC(N)=O.O=Cc1ccccc1

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
CYP2A6 P11509 1/20 0.61
HTT P42858 1/20 0.46
KMT2A Q03164 2/20 0.44
UNG P13051 1/20 0.44
HAO1 Q9UJM8 1/20 0.41
HDAC3 O15379 2/20 0.41
HDAC4 P56524 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
PAM P19021 1/20 0.41
RECQL P46063 2/20 0.40
MCL1 Q07820 1/20 0.40
TNKS O95271 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40

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
Benzaldehyde SCHEMBL27768995 0.86 ALDH1A1 (0.74) ALDH1A1CYP2A6HTTKMT2AUNG
Benzaldehyde SCHEMBL10734023 0.86 ALDH1A1 (0.74) ALDH1A1CYP2A6HTTKMT2AUNG
Benzaldehyde SCHEMBL12819205 0.84 ALDH1A1 (0.70) ALDH1A1CYP2A6HTTKMT2AUNG
Benzaldehyde SCHEMBL23923705 0.83 ALDH1A1 (0.61) ALDH1A1CYP2A6HTTKMT2AUNG
Benzaldehyde SCHEMBL11228895 0.82 ALDH1A1 (0.67) ALDH1A1CYP2A6KMT2AUNGHAO1
Benzaldehyde SCHEMBL27739369 0.82 ALDH1A1 (0.67) ALDH1A1CYP2A6HTTKMT2AUNG
Benzaldehyde SCHEMBL28122866 0.82 ALDH1A1 (0.67) ALDH1A1CYP2A6KMT2AUNGHAO1
Benzaldehyde SCHEMBL7762594 0.81 ALDH1A1 (0.82) ALDH1A1CYP2A6KMT2AUNGHDAC3
Benzaldehyde SCHEMBL7772542 0.81 ALDH1A1 (0.82) ALDH1A1CYP2A6KMT2AUNGHDAC3
Benzaldehyde SCHEMBL30453456 0.81 ALDH1A1 (0.82) ALDH1A1CYP2A6KMT2AUNGHDAC3

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
CN-114641274-B Oil-in-water type composition 株式会社资生堂 2024-06-04 CN disclosed
CN-114929184-A Powder dispersion composition, emulsion composition and cosmetic 株式会社资生堂 2022-08-19 CN disclosed
CN-114641274-A Oil-in-water type composition 株式会社资生堂 2022-06-17 CN disclosed