SCHEMBL7355495

SCHEMBL7355495

COc1[c]ccc(-c2ccc(C)cc2)c1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 1/20 0.38
PDE4B Q07343 5/20 0.36
PDE4A P27815 4/20 0.36
PDE4C Q08493 4/20 0.36
PDE4D Q08499 4/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
BACE1 P56817 1/20 0.33
SQOR Q9Y6N5 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL7468941 0.92 PDE4B (0.40) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL7470694 0.86 SQOR (0.40) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL10415463 0.85 MAPT (0.41) PDE4BPDE4APDE4CPDE4DNPC1
SCHEMBL7471844 0.81 ALDH1A1 (0.35) PDE4BPDE4APDE4CPDE4DNPC1
SCHEMBL7467257 0.79 TOP1 (0.41) NPC1RAB9ATDP1NFKB1NFKB2
SCHEMBL9955938 0.79 PTGS2 (0.36) NPC1RAB9AMEN1KMT2ASQOR
SCHEMBL6991078 0.78 SQOR (0.41) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL7466427 0.78 APP (0.42) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL4439979 0.78 ALDH1A1 (0.42) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL7467196 0.78 PDGFRB (0.35) PDE4BPDE4APDE4CPDE4DALDH1A1

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-1091945-A1 CYCLIC CARBAMATES AND ISOXAZOLIDINES AS IIB/IIIA ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2001-04-18 EP disclosed
WO-2000000481-A1 CYCLIC CARBAMATES AND ISOXAZOLIDINES AS IIB/IIIA ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 2000-01-06 WO disclosed