SCHEMBL29664311

SCHEMBL29664311

O=CCCCC(=O)C=Cc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.69
HAO1 Q9UJM8 1/20 0.54
HSP90AA1 P07900 2/20 0.51
RAB9A P51151 4/20 0.50
MAPT P10636 4/20 0.50
KMT2A Q03164 3/20 0.50
HDAC3 O15379 3/20 0.50
HDAC4 P56524 3/20 0.50
HDAC1 Q13547 3/20 0.50
HDAC2 Q92769 3/20 0.50
HDAC8 Q9BY41 3/20 0.50
HDAC6 Q9UBN7 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PLIN1 O60240 2/20 0.50
LMNA P02545 2/20 0.50
RECQL P46063 2/20 0.50
PLIN5 Q00G26 2/20 0.50
ABHD5 Q8WTS1 2/20 0.50
HDAC7 Q8WUI4 2/20 0.50
HDAC10 Q969S8 2/20 0.50

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
SCHEMBL12832172 1.00 ALDH1A1 (0.69) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL4458908 0.89 ALDH1A1 (0.73) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL13039630 0.83 ALDH1A1 (0.88) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL1285622 0.82 ALDH1A1 (1.00) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL1285623 0.82 ALDH1A1 (1.00) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL5656738 0.81 ALDH1A1 (0.77) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL3395879 0.81 ALDH1A1 (0.66) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL11269994 0.81 ALDH1A1 (0.66) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL11269997 0.81 ALDH1A1 (0.66) ALDH1A1HAO1HSP90AA1RAB9AMAPT
SCHEMBL3395878 0.81 ALDH1A1 (0.66) ALDH1A1HAO1HSP90AA1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108988-A Synthesis and use of polyfunctional diaziridines binders for elastomer bonding 元平台技术有限公司 2022-09-27 CN disclosed
CN-114845721-A Otic formulations for drug-induced ototoxicity 奥德纳米有限公司 2022-08-02 CN disclosed
CN-114728993-A Thiophosphate and phosphine sulfide derivative monomer and polymer for volume Bragg grating 脸谱科技有限责任公司 2022-07-08 CN disclosed
CN-114728894-A Anthraquinone derivative monomer and polymer for volume Bragg grating 脸谱科技有限责任公司 2022-07-08 CN disclosed
CN-114728893-A Aromatic substituted methane-core monomers and polymers thereof for volume bragg gratings 脸谱科技有限责任公司 2022-07-08 CN disclosed
CN-114728889-A Aromatic substituted alkane-nuclear monomers and polymers thereof for volume bragg gratings 脸谱科技有限责任公司 2022-07-08 CN disclosed