Benzaldehyde

Benzaldehyde

SCHEMBL5077244

COC(=O)C(=O)c1ccccc1.O=Cc1ccccc1

nearest known ligand 0.55

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.50
▸ CYP2A6 P11509 1/20 0.50
▸ TSHR P16473 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CES2 O00748 5/20 0.46
▸ CES1 P23141 5/20 0.46
▸ UNG P13051 1/20 0.46
▸ KMT2A Q03164 1/20 0.42
▸ HPGD P15428 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ MAPT P10636 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
SCHEMBL28435221 0.87 ALDH1A1 (0.66) ALDH1A1CYP2A6CES2CES1MAPT
SCHEMBL42428 0.87 TSHR (0.60) ALDH1A1TSHRLMNACES2CES1
Benzene SCHEMBL28195988 0.87 TSHR (0.60) ALDH1A1TSHRLMNACES2CES1
Formic Acid Methyl Ester SCHEMBL28225363 0.85 TSHR (0.50) ALDH1A1TSHRLMNACES2CES1
Water SCHEMBL27445378 0.85 ALDH1A1 (0.63) ALDH1A1CYP2A6CES2CES1MAPT
Hydrochloric Acid SCHEMBL31042902 0.85 TSHR (0.58) ALDH1A1TSHRLMNACES2CES1
Methyl Alcohol SCHEMBL27896190 0.85 TSHR (0.58) ALDH1A1TSHRLMNACES2CES1
Water SCHEMBL27946908 0.85 TSHR (0.58) ALDH1A1TSHRLMNACES2CES1
SCHEMBL28101906 0.83 TSHR (0.56) ALDH1A1TSHRCES2CES1HPGD
Benzil SCHEMBL7790900 0.82 CES2 (0.67) ALDH1A1CYP2A6TSHRLMNACES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578848-A4 REINFORCED POLYMER COMPOSITION SPECIALTY COATINGS AUST PTY LT (AU) 2007-05-16 — — EP claimed
US-20060024482-A1 Reinforced polymer composition SPECIALTY COATINGS (AUST) PTY LTD. (AU) 2006-02-02 — — US claimed
EP-1578848-A1 REINFORCED POLYMER COMPOSITION Specialty Coatings (Aust) Pty Ltd (AU) 2005-09-28 — — EP claimed
WO-2004050750-A1 REINFORCED POLYMER COMPOSITION SPECIALTY COATINGS (AUST) PTY LTD (AU) 2004-06-17 — — WO claimed
WO-2008062231-A2 IMPROVEMENTS IN OR RELATING TO POLYMER COMPOSITES CURON LIMITED (GB) 2008-05-29 — — WO disclosed
US-20080124576-A1 POLYMER COMPOSITES CURON LIMITED (GB) 2008-05-29 — — US disclosed
EP-1578848-A4 REINFORCED POLYMER COMPOSITION SPECIALTY COATINGS AUST PTY LT (AU) 2007-05-16 — — EP disclosed
US-20060024482-A1 Reinforced polymer composition SPECIALTY COATINGS (AUST) PTY LTD. (AU) 2006-02-02 — — US disclosed
EP-1578848-A1 REINFORCED POLYMER COMPOSITION Specialty Coatings (Aust) Pty Ltd (AU) 2005-09-28 — — EP disclosed
WO-2004050750-A1 REINFORCED POLYMER COMPOSITION SPECIALTY COATINGS (AUST) PTY LTD (AU) 2004-06-17 — — WO disclosed
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