SCHEMBL7532436

SCHEMBL7532436

Cc1ccc(Nc2ccco2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.50
GSK3B P49841 1/20 0.45
GAA P10253 6/20 0.42
POLB P06746 3/20 0.42
SMN1; SMN2 Q16637 6/20 0.41
MAPT P10636 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
RAPGEF4 Q8WZA2 1/20 0.41
RAB9A P51151 7/20 0.41
NPC1 O15118 6/20 0.41
ALDH1A1 P00352 5/20 0.41
HTT P42858 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL18643872 0.82 RAB9A (0.40) HPGDGSK3BGAAPOLBSMN1; SMN2
SCHEMBL6985407 0.80 HSD17B10 (0.50) HPGDGAASMN1; SMN2MAPTTDP1
SCHEMBL7532433 0.79 AKT1 (0.36) GSK3BGAASMN1; SMN2MAPTTDP1
SCHEMBL28833087 0.79 SMN1; SMN2 (0.51) HPGDGAASMN1; SMN2MAPTRAB9A
SCHEMBL28874218 0.79 NPC1 (0.47) HPGDPOLBSMN1; SMN2MAPTTDP1
SCHEMBL28304722 0.79 RAB9A (0.47) HPGDGAAPOLBSMN1; SMN2MAPT
SCHEMBL30416990 0.79 NPSR1 (0.55) HPGDGAAPOLBSMN1; SMN2MAPT
SCHEMBL976980 0.77 TP53 (0.41) HPGDPOLBSMN1; SMN2MAPTTDP1
SCHEMBL30925347 0.71 ADRA2C (0.50) GAASMN1; SMN2MAPTTDP1RAB9A
SCHEMBL108881 0.71 HPGD (0.78) HPGDGAASMN1; SMN2MAPTTDP1

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
EP-0805796-B1 CELL ADHESION INHIBITORS BIOGEN INC (US) 2002-12-11 EP claimed
CN-110054631-A Bromo- 4- chlorine furans [2,3-b] quinoline of 2-, derivative and synthetic method and application 中国药科大学 2019-07-26 CN disclosed