SCHEMBL8961820

SCHEMBL8961820

CCN(CC)C(CC)(Cc1ccccc1)C(=O)c1ccc(OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.48
NPC1 O15118 3/20 0.48
ACHE P22303 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
THRB P10828 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
PLAU P00749 1/20 0.43
ELANE P08246 1/20 0.43
ALDH1A1 P00352 4/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 2/20 0.43
ALOX12 P18054 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
GPR52 Q9Y2T5 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
SCHEMBL4651504 0.88 ACHE (0.51) RAB9ANPC1ACHEL3MBTL1SMN1; SMN2
SCHEMBL8899530 0.88 ACHE (0.51) RAB9ANPC1ACHEL3MBTL1SMN1; SMN2
SCHEMBL4651502 0.83 ACHE (0.48) RAB9ANPC1ACHEL3MBTL1SMN1; SMN2
SCHEMBL8897587 0.83 ACHE (0.57) RAB9ANPC1ACHEL3MBTL1SMN1; SMN2
SCHEMBL14156794 0.79 NPY5R (0.47) RAB9ANPC1ACHESMN1; SMN2ALDH1A1
SCHEMBL8631398 0.78 ACHE (0.43) RAB9ANPC1ACHESMN1; SMN2TDP1
SCHEMBL28032703 0.78 NPY5R (0.49) RAB9ANPC1ACHESMN1; SMN2ALDH1A1
SCHEMBL27853189 0.78 ALDH1A1 (0.43) RAB9ANPC1ACHEL3MBTL1SMN1; SMN2
SCHEMBL5590415 0.77 L3MBTL1 (0.45) RAB9ANPC1ACHEL3MBTL1SMN1; SMN2
SCHEMBL1781930 0.76 SMN1; SMN2 (0.47) RAB9ANPC1L3MBTL1SMN1; SMN2ALDH1A1

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-5554663-A α-aminoacetophenones as photoinitiators CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed