Benzaldehyde

Benzaldehyde

SCHEMBL8515995

C=C(C)C(=O)O.O=Cc1ccccc1

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
CYP2A6 P11509 1/20 0.61
AKR1C3 P42330 1/20 0.52
HTT P42858 1/20 0.47
TSHR P16473 1/20 0.47
GLA P06280 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KMT2A Q03164 1/20 0.44
UNG P13051 1/20 0.44
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
KDM4E B2RXH2 1/20 0.41
AKR1C1 Q04828 1/20 0.41
RECQL P46063 2/20 0.40
HDAC3 O15379 1/20 0.40
TNKS O95271 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40
HDAC7 Q8WUI4 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 SCHEMBL8009927 0.91 ALDH1A1 (0.67) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL15543028 0.89 ALDH1A1 (0.70) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL10800754 0.86 ALDH1A1 (0.67) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL28875680 0.86 ALDH1A1 (0.67) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL28392702 0.86 ALDH1A1 (0.45) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL11274415 0.86 ALDH1A1 (0.74) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL5033079 0.86 ALDH1A1 (0.74) ALDH1A1CYP2A6AKR1C3HTTTSHR
Benzaldehyde SCHEMBL3214665 0.86 ALDH1A1 (0.74) ALDH1A1CYP2A6AKR1C3HTTTSHR
(Z)-1,2-Diphenylethene SCHEMBL9983047 0.84 GLA (0.59) ALDH1A1AKR1C3GLATDP1RECQL
Benzaldehyde SCHEMBL5030151 0.84 ALDH1A1 (0.64) ALDH1A1CYP2A6AKR1C3HTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115960424-B Flexible fire-resistant robot cable 卡尔德线缆(东莞)有限公司 2024-01-30 CN claimed
CN-115960424-A Flexible fire-resistant robot cable 卡尔德线缆(东莞)有限公司 2023-04-14 CN claimed
CN-115960424-B Flexible fire-resistant robot cable 卡尔德线缆(东莞)有限公司 2024-01-30 CN disclosed
CN-115960424-A Flexible fire-resistant robot cable 卡尔德线缆(东莞)有限公司 2023-04-14 CN disclosed
CN-112300306-B Biodegradable radiation-curable (methyl) acrylate and preparation method thereof 广东石油化工学院 2022-03-29 CN disclosed
CN-109370131-A A kind of dynamic topology interlocking dual network and its preparation method and application 中山大学 2019-02-22 CN disclosed
US-5872197-A ACRYLIC MONOMERWITH ORGANOBORANE AMINE COMPLEX AND DECOMPLEXER MINNESOTA MINING & MANUFACTURING COMPANY (US) 1999-02-16 US disclosed