SCHEMBL8976405

SCHEMBL8976405

C/C(=C\c1ccccc1)C(=O)N1CCN(Cc2cccc3ccccc23)CC1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.58
KMT2A Q03164 6/20 0.58
FAAH O00519 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MGLL Q99685 1/20 0.49
ACHE P22303 1/20 0.48
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL8976410 1.00 MEN1 (0.58) MEN1KMT2AFAAHSMN1; SMN2KDM4E
SCHEMBL8954085 0.81 KMT2A (0.69) MEN1KMT2AFAAHSMN1; SMN2KDM4E
SCHEMBL8954080 0.81 KMT2A (0.69) MEN1KMT2AFAAHSMN1; SMN2KDM4E
SCHEMBL16673587 0.80 FAAH (0.71) MEN1KMT2AFAAHSMN1; SMN2KDM4E
SCHEMBL8976961 0.79 ALDH1A1 (0.55) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL8976956 0.79 ALDH1A1 (0.55) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL16598924 0.79 APP (0.65) MEN1KMT2AFAAHSMN1; SMN2ALDH1A1
SCHEMBL16598922 0.79 APP (0.65) MEN1KMT2AFAAHSMN1; SMN2ALDH1A1
SCHEMBL8976627 0.77 MEN1 (0.67) MEN1KMT2AFAAHSMN1; SMN2KDM4E
SCHEMBL8976630 0.77 MEN1 (0.67) MEN1KMT2AFAAHSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0707004-A1 1-Arylalcenyl 4-arylmethylpiperazinderivatives, process for their preparation and pharmaceutical composition containing them ADIR ET COMPAGNIE (FR) 1996-04-17 EP disclosed