SCHEMBL5804196

SCHEMBL5804196

COc1ccc(-c2c[nH]c(-c3ccc(C)c(-c4ccccc4OC)c3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.44
MAPT P10636 4/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 3/20 0.41
HSD17B10 Q99714 2/20 0.41
USP2 O75604 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HTR7 P34969 2/20 0.41
NR1H4 Q96RI1 1/20 0.40
AVPR2 P30518 1/20 0.40
OXTR P30559 1/20 0.40
AVPR1A P37288 1/20 0.40
DYRK1A Q13627 1/20 0.39

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
SCHEMBL5806550 0.82 SMN1; SMN2 (0.40) MAPTNPC1RAB9AALDH1A1HTT
SCHEMBL5801973 0.80 HTR7 (0.44) PDGFRBHTR7S1PR1KITDHODH
SCHEMBL17280155 0.79 MEN1 (0.49) PDGFRBMAPTKDM4EALDH1A1HPGD
SCHEMBL17279819 0.78 NPC1 (0.50) PDGFRBMAPTNPC1RAB9AKDM4E
SCHEMBL5803521 0.78 DHODH (0.43) MAPTLMNAKMT2AHTR7S1PR1
SCHEMBL7142078 0.77 NPC1 (0.51) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL650259 0.77 NPC1 (0.51) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL11771726 0.76 KDM4E (0.50) PDGFRBMAPTNPC1RAB9AKDM4E
SCHEMBL8142183 0.76 AURKA (0.47) PDGFRBMAPTNPC1RAB9AKDM4E
SCHEMBL5802708 0.75 ALOX5 (0.42) PDGFRBMAPTRAB9AKDM4EHPGD

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-1723117-A2 ION CHANNEL MODULATORS Wyeth a Corporation of the State of Delaware (US) 2006-11-22 EP disclosed
WO-2005086836-A2 ION CHANNEL MODULATORS WYETH (US) 2005-09-22 WO disclosed