SCHEMBL8490476

SCHEMBL8490476

Oc1ccccc1-c1cc(Br)ccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.50
GSTA1 P08263 1/20 0.50
HPGD P15428 5/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
GLA P06280 1/20 0.47
MAPK1 P28482 1/20 0.47
IDO1 P14902 1/20 0.47
PTPRC P08575 1/20 0.47
BCL2 P10415 1/20 0.45
MCL1 Q07820 1/20 0.45
ALDH1A1 P00352 1/20 0.44
BCL2L1 Q07817 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CES2 O00748 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
SCHEMBL20321776 0.89 HPGD (0.48) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL8743338 0.88 ALOX15 (0.62) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL27991140 0.88 ALOX15 (0.62) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL8635 0.84 MAPT (0.61) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL29041366 0.84 MAPT (0.54) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL30423492 0.84 MAPT (0.54) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL29886961 0.84 MAPT (0.61) ALOX15GSTA1HPGDMAPTMEN1
SCHEMBL6269206 0.84 MAPT (0.61) ALOX15HPGDMAPTMEN1KMT2A
SCHEMBL4636219 0.81 ESR2 (0.55) ALOX15HPGDMAPTMEN1KMT2A
SCHEMBL8124885 0.81 POLB (0.48) ALOX15HPGDMAPTMEN1KMT2A

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
CN-107597196-B Preparation method of organic graphene nanotube with surface modified with titanium dioxide 东华大学 2020-01-17 CN disclosed
WO-1999038857-A2 METHOD FOR PRODUCING 5-ALKOXY (OR 5-AROXY)-2,3-DIHYDROFURAN-2-ONES MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1999-08-05 WO disclosed