SCHEMBL9864154

SCHEMBL9864154

[CH2]CCC(=O)CCC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
LMNA P02545 1/20 0.46
SLC15A2 Q16348 1/20 0.46
KDM4E B2RXH2 1/20 0.39
KDM6B O15054 1/20 0.39
KDM5C P41229 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
ACHE P22303 1/20 0.33
PAOX Q6QHF9 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TRPA1 O75762 1/20 0.32

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
SCHEMBL2439884 0.85 ALDH1A1 (0.77) ALDH1A1LMNASLC15A2KDM4EKDM6B
SCHEMBL11041667 0.85 ACE (0.36) ALDH1A1
SCHEMBL8155389 0.85 ALDH1A1 (0.77) ALDH1A1LMNASLC15A2KDM4EKDM6B
SCHEMBL10689700 0.83 ALDH1A1 (0.56) ALDH1A1LMNASLC15A2KDM4EKDM6B
SCHEMBL28966701 0.82 ALDH1A1 (0.71) ALDH1A1LMNASLC15A2KDM4EKDM6B
SCHEMBL128923 0.82
SCHEMBL6932133 0.82
SCHEMBL6516067 0.80
SCHEMBL29187674 0.78 ALDH1A1 (0.56) ALDH1A1LMNASLC15A2KDM4EKDM6B
SCHEMBL8507919 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0191542-B1 ARYLCYCLOBUTYLALKYL AMINES AND THEIR USE AS ANTIDEPRESSIVE MEDICINES The Boots Company PLC (GB) 1988-06-08 EP claimed
EP-0191542-A1 Arylcyclobutylalkyl amines and their use as antidepressive medicines The Boots Company PLC (GB) 1986-08-20 EP claimed
CN-117413012-A Silane coupling agent composition and rubber composition containing same 引能仕株式会社 2024-01-16 CN disclosed
CN-1318419-C 1,6,9,14-tetrasubstituted terrylene tetracarboxylic acid diimides BASF AG (DE) 2007-05-30 CN disclosed
CN-1659167-A 1,6,9,14-tetrasubstituted terrylene tetracarboxylic acid diimides BASF AG (DE) 2005-08-24 CN disclosed
US-5047432-A Antidepressants THE BOOTS COMPANY PLC (GB) 1991-09-10 US disclosed
CN-1012733-B Process for the preparation of therapeutic agents BOOTS CO PLC (GB) 1991-06-05 CN disclosed
US-4925879-A ANTIDEPRESSANTS BOOTS COMPANY, PLC (GB) 1990-05-15 US disclosed
EP-0191542-B1 ARYLCYCLOBUTYLALKYL AMINES AND THEIR USE AS ANTIDEPRESSIVE MEDICINES The Boots Company PLC (GB) 1988-06-08 EP disclosed
CN-86100954-A The preparation method of therapeutical agent and application 1986-09-03 CN disclosed
EP-0191542-A1 Arylcyclobutylalkyl amines and their use as antidepressive medicines The Boots Company PLC (GB) 1986-08-20 EP disclosed