SCHEMBL11638240

SCHEMBL11638240

CCCCNC(=O)ON=C1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
FAAH O00519 1/20 0.48
ABHD16A O95870 1/20 0.48
PLA2G7 Q13093 1/20 0.48
NCEH1 Q6PIU2 1/20 0.48
DAGLB Q8NCG7 1/20 0.48
DAGLA Q9Y4D2 1/20 0.48
MAPK1 P28482 1/20 0.47
ACHE P22303 11/20 0.41
EPHX1 P07099 1/20 0.38
ALDH1A1 P00352 1/20 0.38
BCHE P06276 1/20 0.37
MGLL Q99685 1/20 0.36

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
SCHEMBL11874581 0.72 MEN1 (0.82) MEN1KMT2AFAAHABHD16APLA2G7
SCHEMBL11872980 0.71 MEN1 (0.85) MEN1KMT2AFAAHABHD16APLA2G7
SCHEMBL11644657 0.69 BCHE (0.40) MEN1KMT2AFAAHABHD16APLA2G7
SCHEMBL3462778 0.66
SCHEMBL23015112 0.65 MEN1 (1.00) MEN1KMT2AFAAHABHD16APLA2G7
SCHEMBL11644293 0.65 ZDHHC2 (0.47) EPHX1
SCHEMBL11641480 0.65 ZDHHC2 (0.47) EPHX1
SCHEMBL23016829 0.65 LMNA (0.44) FAAHALDH1A1
SCHEMBL8153165 0.64 ACHE (0.53) ACHEEPHX1BCHE
SCHEMBL13942586 0.64

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
US-4104251-A POLYMER STABILIZERS HOECHST AKTIENGESELLSCHAFT (DE) 1978-08-01 US disclosed