Acetaldehyde

Acetaldehyde

SCHEMBL18815520

CC=O.Oc1ccc2cc1-2

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.43
▸ APP P05067 2/20 0.43
▸ ALOX5 P09917 6/20 0.42
▸ GABRA1 P14867 3/20 0.41
▸ GABRB2 P47870 3/20 0.41
▸ RXRA P19793 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ SIRT3 Q9NTG7 1/20 0.41
▸ RARA P10276 1/20 0.41
▸ RARB P10826 1/20 0.41

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
Formic Acid SCHEMBL27598190 0.88 APP (0.44) CNR2APPALOX5GABRA1GABRB2
Methylamine SCHEMBL28044974 0.82 — —
Acetic Acid SCHEMBL1662353 0.81 RARA (0.47) APPALOX5RXRAMEN1POLB
Pyruvate SCHEMBL935493 0.77 RARA (0.45) APPALOX5RXRAMEN1POLB
Cyanide SCHEMBL28038481 0.77 — —
SCHEMBL29171599 0.77 APP (0.48) CNR2APPALOX5GABRA1GABRB2
Boric Acid SCHEMBL29171600 0.77 APP (0.48) CNR2APPALOX5GABRA1GABRB2
Ethylamine SCHEMBL11810037 0.76 ALOX5 (0.50) CNR2APPALOX5GABRA1GABRB2
SCHEMBL27475510 0.76 RARA (0.41) CNR2APPALOX5GABRA1GABRB2
Methane SCHEMBL28580924 0.74 APP (0.41) CNR2APPALOX5GABRA1GABRB2

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
WO-2019113710-A9 BENZYLISOQUINOLINE UPTAKE PERMEASES AND METHODS OF USING Willow Biosciences Inc. (CA) 2020-02-20 — — WO claimed
WO-2019113710-A1 BENZYLISOQUINOLINE UPTAKE PERMEASES AND METHODS OF USING SERTURNER CORP. (CA) 2019-06-20 — — WO claimed
US-20170130250-A1 Compositions and Methods For Making (S)-Norcoclaurine and (S)-Norlaudanosoline, and Synthesis Intermediates Thereof HERCULES CAPITAL, INC., AS AGENT 2017-05-11 — — US claimed
WO-2022150380-A1 ALKALOID PRODUCING OXIDASES AND CARBOXY-LYASES AND METHODS OF USE NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2022-07-14 — — WO disclosed
US-10662453-B2 Compositions and methods for making (S)-norcoclaurine and (S)-norlaudanosoline, and synthesis intermediates thereof Willow Biosciences Inc. (CA) 2020-05-26 — — US disclosed
WO-2019113710-A9 BENZYLISOQUINOLINE UPTAKE PERMEASES AND METHODS OF USING Willow Biosciences Inc. (CA) 2020-02-20 — — WO disclosed
EP-3158073-B1 COMPOSITIONS AND METHODS FOR MAKING (S)-NORCOCLAURINE AND (S)-NORLAUDANOSOLINE, AND SYNTHESIS INTERMEDIATES THEREOF EPIMERON INC (CA) 2019-10-23 — — EP disclosed
WO-2019113710-A1 BENZYLISOQUINOLINE UPTAKE PERMEASES AND METHODS OF USING SERTURNER CORP. (CA) 2019-06-20 — — WO disclosed
US-10119155-B2 Compositions and methods for making (S)-norcoclaurine and (S)-norlaudanosoline, and synthesis intermediates thereof EPIMERON INC. (CA) 2018-11-06 — — US disclosed
US-20170130250-A1 Compositions and Methods For Making (S)-Norcoclaurine and (S)-Norlaudanosoline, and Synthesis Intermediates Thereof HERCULES CAPITAL, INC., AS AGENT 2017-05-11 — — US disclosed
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