SCHEMBL9517796

SCHEMBL9517796

CC(=O)Cc1ccc(OCC(N)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 4/20 0.45
BLM P54132 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 1/20 0.45
LMNA P02545 1/20 0.44
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
CNR1 P21554 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44

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
SCHEMBL9811886 0.85 MEN1 (0.50) POLBMEN1KMT2ATDP1BLM
SCHEMBL23582938 0.84 PLA2G4B (0.55) MEN1KMT2ARAB9AMAPT
SCHEMBL14939906 0.84 ALOX15 (0.57) POLBMEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL23582929 0.83 MEN1 (0.54) MEN1KMT2ATDP1RAB9AL3MBTL1
SCHEMBL10506137 0.82 MEN1 (0.58) POLBMEN1KMT2ATDP1BLM
SCHEMBL9450347 0.82 MEN1 (0.49) POLBMEN1KMT2ATDP1BLM
SCHEMBL1480561 0.81 RXRA (0.53) KMT2ARAB9ASMN1; SMN2NPSR1MAPT
SCHEMBL8879627 0.81 POLB (0.53) POLBMEN1KMT2ATDP1RAB9A
SCHEMBL11196500 0.80 NPSR1 (0.51) MEN1KMT2ATDP1L3MBTL1SMN1; SMN2
SCHEMBL13839306 0.80 PLA2G4B (0.46) MEN1KMT2ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0236624-B1 SUBSTITUTED PHENYL ETHANOL AMINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1993-08-11 EP disclosed
US-5153210-A Hypoglycemic agent, animal growth regulator; veterinary medicine BEECHAM GROUP P.L.C. (GB) 1992-10-06 US disclosed
EP-0236624-A2 Substituted phenyl ethanol amines, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1987-09-16 EP disclosed