SCHEMBL9424092

SCHEMBL9424092

CCCCC(CC(=O)OC)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
POLB P06746 1/20 0.49
KCNA5 P22460 1/20 0.45
F2 P00734 7/20 0.44
F10 P00742 5/20 0.44
HDAC3 O15379 2/20 0.44
HDAC4 P56524 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC7 Q8WUI4 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC9 Q9UKV0 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
PRSS1 P07477 4/20 0.43
CNR2 P34972 1/20 0.43
NAAA Q02083 2/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL28267935 0.94 ALDH1A1 (0.50) ALDH1A1POLBHDAC3HDAC4HDAC1
SCHEMBL27323723 0.90 ALDH1A1 (0.55) ALDH1A1KCNA5F2F10PRSS1
SCHEMBL3874428 0.86 ESR1 (0.44) ALDH1A1F2F10PRSS1
SCHEMBL28008718 0.86 F2 (0.58) ALDH1A1POLBF2F10PRSS1
SCHEMBL3873610 0.86 ESR1 (0.44) ALDH1A1F2F10PRSS1
SCHEMBL3873609 0.86 ESR1 (0.44) ALDH1A1F2F10PRSS1
SCHEMBL28262487 0.86 POLB (0.48) ALDH1A1POLBHDAC3HDAC4HDAC1
SCHEMBL7995142 0.85 ALDH1A1 (0.67) ALDH1A1POLBKCNA5KMT2A
SCHEMBL2494838 0.84 F10 (0.48) ALDH1A1F2F10PRSS1
SCHEMBL2497746 0.84 F10 (0.48) ALDH1A1F2F10PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119258060-A Application of autophagy inducer in preparation of anti-skin sensitization drugs 深圳市药品检验研究院(深圳市医疗器械检测中心) 2025-01-07 CN claimed
CN-119258060-A Application of autophagy inducer in preparation of anti-skin sensitization drugs 深圳市药品检验研究院(深圳市医疗器械检测中心) 2025-01-07 CN disclosed
CN-114292829-A Lipase variants and polynucleotides encoding same 诺维信公司 2022-04-08 CN disclosed
CN-107969136-B Lipase variants and polynucleotides encoding same 诺维信公司 2021-12-21 CN disclosed
CN-110651038-A Composition comprising lipase and sulfite 诺维信公司 2020-01-03 CN disclosed
CN-101115482-A Heterocyclic aspartyl protease inhibitors SCHERING CORP (US) 2008-01-30 CN disclosed
US-5312828-A Substituted imidazoles having angiotensin II receptor blocking activity SMITHKLINE BEECHAM CORPORATION A CORP. OF PENNSYLVANIA 1994-05-17 US disclosed
EP-0403158-A2 Imidazolyl-alkenoic acids SMITHKLINE BEECHAM CORPORATION (US) 1990-12-19 EP disclosed