SCHEMBL8713328

SCHEMBL8713328

NC(F)CCc1ccc(O)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.57
KDM4E B2RXH2 5/20 0.57
MAPT P10636 4/20 0.57
MAPK1 P28482 4/20 0.57
HIF1A Q16665 4/20 0.57
HSD17B10 Q99714 4/20 0.57
RECQL P46063 3/20 0.57
TDP1 Q9NUW8 3/20 0.57
ADRA2A P08913 3/20 0.57
DRD2 P14416 3/20 0.57
DRD1 P21728 3/20 0.57
DRD4 P21917 3/20 0.57
SLC6A2 P23975 3/20 0.57
DRD3 P35462 3/20 0.57
SLC6A3 Q01959 3/20 0.57
THPO P40225 3/20 0.57
ADRB2 P07550 3/20 0.57
DRD5 P21918 2/20 0.57
ALDH1A1 P00352 2/20 0.57
PTGS1 P23219 2/20 0.57

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
SCHEMBL6339564 1.00 ALOX15 (0.57) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL11422131 0.81 KDM4E (0.57) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL5314945 0.79 KDM4E (0.57) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL22082812 0.78 ALOX15 (0.61) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL5287328 0.77 KDM4E (0.70) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL30631592 0.76 ALOX15 (0.80) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL107956 0.76 ALOX15 (0.80) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL1291747 0.76 ALOX15 (0.59) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL30010190 0.74 ADRB2 (0.73) ALOX15KDM4EMAPTMAPK1HIF1A
SCHEMBL1260613 0.74 ALOX15 (0.57) ALOX15KDM4EMAPTMAPK1HIF1A

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-5773592-A COMPRISES A CHEMILUMINESCENT MOIETY, A PHOTOCHROMIC MOIETY AND A BIOLOGICALLY ACTIVE AGENT CAPABLE OF BEING RELEASED MILLS RANDELL LEE (US) 1998-06-30 US disclosed