SCHEMBL8518564

SCHEMBL8518564

Cc1ncc(OCc2ccccc2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.50
PDGFRA P16234 1/20 0.50
ALKBH1 Q13686 4/20 0.47
MAOB P27338 4/20 0.46
P4HTM Q9NXG6 1/20 0.45
ALOX5 P09917 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
STAT3 P40763 1/20 0.44
HTT P42858 1/20 0.44
PRMT5 O14744 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
PTGS1 P23219 1/20 0.43
SLC6A2 P23975 1/20 0.43
CYP2C19 P33261 1/20 0.43
PTGS2 P35354 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HIF1A Q16665 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL28652239 0.81 PDGFRB (0.50) PDGFRBPDGFRAALKBH1MAOBP4HTM
SCHEMBL30296052 0.81 PDGFRB (0.47) PDGFRBPDGFRAALKBH1MAOBP4HTM
SCHEMBL7413609 0.81 PDGFRB (0.54) PDGFRBPDGFRAALKBH1MAOBP4HTM
SCHEMBL7409633 0.81 MAOB (0.50) PDGFRBPDGFRAALKBH1MAOBP4HTM
SCHEMBL14676863 0.81 PDGFRB (0.50) PDGFRBPDGFRAALKBH1MAOBP4HTM
SCHEMBL21538106 0.80 MAPT (0.52) MAOBALOX5SMN1; SMN2L3MBTL1LMNA
SCHEMBL25956020 0.78 LTA4H (0.43) MAOBSMN1; SMN2L3MBTL1LMNARAB9A
SCHEMBL10707032 0.77 P4HTM (0.56) ALKBH1P4HTMSMN1; SMN2ALDH1A1RAB9A
SCHEMBL12180347 0.77 DRD2 (0.56) MAOBALOX5SMN1; SMN2L3MBTL1LMNA
SCHEMBL3196407 0.75 ALOX5 (0.53) MAOBALOX5SMN1; SMN2PRMT5L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869507-A Azatyrosine analogues Wang, Hui-Po (TW) 1999-02-09 US disclosed
WO-1999004792-A1 NOVEL AZATYROSINE ANALOGUES AND PROCESS OF PREPARATION THEREOF TSAI, HANSEN (TW) 1999-02-04 WO disclosed