SCHEMBL7048824

SCHEMBL7048824

O=C(O)N(c1ccccc1)n1cnc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
EGLN3 Q9H6Z9 1/20 0.45
HSD17B10 Q99714 3/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
AGER Q15109 1/20 0.43
APAF1 O14727 1/20 0.42
HTT P42858 2/20 0.42
NPC1 O15118 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
ASAH1 Q13510 1/20 0.41
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 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
SCHEMBL15157208 0.80 TP53 (0.43) SMN1; SMN2EGLN3HSD17B10MAPTPOLB
SCHEMBL1516437 0.79 SMN1; SMN2 (0.54) SMN1; SMN2EGLN3HSD17B10MAPTAGER
SCHEMBL23529284 0.78 CYP11B1 (0.49) SMN1; SMN2EGLN3HSD17B10MAPTPOLB
SCHEMBL9162968 0.76 SMN1; SMN2 (0.48) SMN1; SMN2EGLN3HSD17B10MAPTAGER
Fluoride SCHEMBL7478380 0.75 SMN1; SMN2 (0.47) SMN1; SMN2EGLN3HSD17B10MAPTPOLB
SCHEMBL9159925 0.75 APAF1 (0.50) SMN1; SMN2EGLN3HSD17B10MAPTPOLB
SCHEMBL11824279 0.73 NPC1 (0.45) SMN1; SMN2EGLN3HSD17B10MAPTAPAF1
SCHEMBL10827990 0.72 HSD17B10 (0.41) SMN1; SMN2EGLN3HSD17B10MAPTAPAF1
SCHEMBL7121803 0.72 EGLN3 (0.43) SMN1; SMN2EGLN3HSD17B10MAPTPOLB
SCHEMBL30723151 0.71 SMN1; SMN2 (0.73) SMN1; SMN2EGLN3HSD17B10MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019722-B1 POLYMERIC FLUOROPHORES ENHANCED BY MOIETIES PROVIDING A HYDROPHOBIC AND CONFORMATIONALLY RESTRICTIVE MICROENVIRONMENT ABBOTT LAB (US) 2003-04-09 EP claimed
EP-1019722-A1 POLYMERIC FLUOROPHORES ENHANCED BY MOIETIES PROVIDING A HYDROPHOBIC AND CONFORMATIONALLY RESTRICTIVE MICROENVIRONMENT Abbott Laboratories (US) 2000-07-19 EP claimed
WO-1997028447-A1 POLYMERIC FLUOROPHORES ENHANCED BY MOIETIES PROVIDING A HYDROPHOBIC AND CONFORMATIONALLY RESTRICTIVE MICROENVIRONMENT ABBOTT LABORATORIES (US) 1997-08-07 WO claimed
EP-1019722-A1 POLYMERIC FLUOROPHORES ENHANCED BY MOIETIES PROVIDING A HYDROPHOBIC AND CONFORMATIONALLY RESTRICTIVE MICROENVIRONMENT Abbott Laboratories (US) 2000-07-19 EP disclosed
WO-1997028447-A1 POLYMERIC FLUOROPHORES ENHANCED BY MOIETIES PROVIDING A HYDROPHOBIC AND CONFORMATIONALLY RESTRICTIVE MICROENVIRONMENT ABBOTT LABORATORIES (US) 1997-08-07 WO disclosed