SCHEMBL8796397

SCHEMBL8796397

CC(=O)Nc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.66
RAB9A P51151 3/20 0.63
MAPT P10636 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
MEN1 O00255 2/20 0.61
HTR1A P08908 1/20 0.57
HTR2A P28223 1/20 0.57
HPGD P15428 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
GAA P10253 1/20 0.56
MAPK1 P28482 1/20 0.56
ALDH1A1 P00352 3/20 0.55
DRD2 P14416 2/20 0.54
SCN2A Q99250 1/20 0.53
TDP1 Q9NUW8 2/20 0.53
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.53
HSD17B10 Q99714 1/20 0.53
NPC1 O15118 1/20 0.52
LMNA P02545 1/20 0.51

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
SCHEMBL11456649 0.83 RAB9A (0.68) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL8298007 0.81 RAB9A (0.79) KMT2ARAB9AMAPTSMN1; SMN2HPGD
SCHEMBL4903484 0.81 RAB9A (0.65) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL16718938 0.81 RAB9A (0.65) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL8486609 0.80 KMT2A (0.67) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL8486911 0.80 ALDH1A1 (0.56) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL8795174 0.80 RAB9A (0.63) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10050510 0.79 RAB9A (0.85) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL5631833 0.79 RAB9A (0.77) KMT2ARAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10603852 0.79 KMT2A (0.70) KMT2ARAB9AMAPTSMN1; SMN2MEN1

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-0792873-A1 N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents American Cyanamid Company (US) 1997-09-03 EP disclosed