SCHEMBL8419487

SCHEMBL8419487

O=Cc1ccccc1OC1CCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
CYP2C19 P33261 1/20 0.56
PDE4B Q07343 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GRIN2B Q13224 8/20 0.48
HTT P42858 1/20 0.48
CYP2D6 P10635 4/20 0.47
CYP2C9 P11712 4/20 0.47
HRH1 P35367 1/20 0.47
F13A1 P00488 1/20 0.46
TGM2 P21980 1/20 0.46
TGM1 P22735 1/20 0.46
SRC P12931 1/20 0.45
CYP3A4 P08684 3/20 0.45
GPR119 Q8TDV5 1/20 0.45
ENPP2 Q13822 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
SCHEMBL8327398 0.87 L3MBTL1 (0.49) PDE4BMEN1KMT2AHRH1
SCHEMBL8418046 0.84 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9ACYP2C19MEN1
SCHEMBL8419333 0.83 GAA (0.57) SMN1; SMN2NPC1RAB9APDE4BMEN1
SCHEMBL1902995 0.82 HRH1 (0.45) SMN1; SMN2MEN1KMT2AHTTHRH1
SCHEMBL6596647 0.81 SMN1; SMN2 (0.58) SMN1; SMN2NPC1RAB9ACYP2C19PDE4B
SCHEMBL8418002 0.81 L3MBTL1 (0.39) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL8417436 0.81 F2 (0.60) SMN1; SMN2PDE4BMEN1KMT2ANPSR1
SCHEMBL5539450 0.80 SMN1; SMN2 (0.67) SMN1; SMN2NPC1RAB9ACYP2C19MEN1
SCHEMBL2306313 0.80 SMN1; SMN2 (0.70) SMN1; SMN2NPC1RAB9ACYP2C19MEN1
SCHEMBL26271938 0.79 SMN1; SMN2 (0.68) SMN1; SMN2NPC1RAB9ACYP2C19PDE4B

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-5889025-A Antidiabetic compounds having hypolipidaemic, antihypertensive properties, process for their preparation and pharmaceutical compositions containing them REDDY'S RESEARCH FOUNDATION (IN) 1999-03-30 US disclosed