Benzaldehyde

Benzaldehyde

SCHEMBL9650000

CNCCCCCCOC(C)=O.O=Cc1ccccc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 7/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HRH1 P35367 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.41
▸ HTR1B P28222 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP2A6 P11509 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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 SCHEMBL9745994 0.92 LTA4H (0.46) LTA4HPTGS2LMNAKDM4EALDH1A1
Acetic Acid Butyl Ester SCHEMBL28599658 0.81 ALDH1A1 (0.58) L3MBTL1TP53CYP3A4TSHRLMNA
SCHEMBL21568850 0.80 ALDH1A1 (0.52) PTGS2TSHRLMNAKDM4EALDH1A1
SCHEMBL23471339 0.80 ALDH1A1 (0.52) PTGS2TSHRLMNAKDM4EALDH1A1
SCHEMBL9551555 0.79 LMNA (0.39) LTA4HPTGS2CYP1A2CYP3A4HRH1
SCHEMBL5953248 0.78 ALDH1A1 (0.54) PTGS2TSHRLMNAALDH1A1
Hydrochloric Acid SCHEMBL1066752 0.77 ALDH1A1 (0.52) PTGS2TSHRLMNAALDH1A1
SCHEMBL6851329 0.75 ALDH1A1 (0.55) LTA4HL3MBTL1TP53TSHRLMNA
SCHEMBL6850263 0.75 ALDH1A1 (0.55) LTA4HL3MBTL1TP53TSHRLMNA
SCHEMBL6847397 0.75 ALDH1A1 (0.55) LTA4HL3MBTL1TP53TSHRLMNA

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
EP-0313474-B1 AN OPTICAL ARTICLE EXHIBITING A HIGH LEVEL OF SECOND ORDER POLARIZATION SUSCEPTIBILITY EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-12-23 — — EP disclosed
EP-0313475-B1 AN OPTICAL ARTICLE CONTAINING A TRANSMISSION MEDIUM EXHIBITING A HIGH LEVEL OF SECOND ORDER POLARIZATION SUSCEPTIBILITY EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-12-23 — — EP disclosed
US-4792208-A POLAR ALIGNED NONCENTROSYMMETRIC MOLECULAR DIPOLES; SULFONYL MOIETY AS ELECTRON ACCEPTOR EASTMAN KODAK COMPANY (US) 1988-12-20 — — US disclosed
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