SCHEMBL8545171

SCHEMBL8545171

O=S(=O)(c1ccccc1)n1c2ccccc2c2cc(C(O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.40
SRC P12931 2/20 0.39
HTR6 P50406 3/20 0.36
PSEN1 P49768 7/20 0.36
PSEN2 P49810 7/20 0.36
APH1B Q8WW43 7/20 0.36
NCSTN Q92542 7/20 0.36
APH1A Q96BI3 7/20 0.36
PSENEN Q9NZ42 7/20 0.36
SIRT2 Q8IXJ6 2/20 0.33
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33
CXCL8 P10145 1/20 0.33
NOD1 Q9Y239 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL8538922 0.94 PSEN1 (0.44) RECQLHTR6PSEN1PSEN2APH1B
SCHEMBL8540330 0.88 PSEN1 (0.48) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL8540926 0.79 KIF11 (0.40) SIRT2ALDH1A1LMNAMAPT
SCHEMBL8541589 0.76 ACSS2 (0.39) ALDH1A1LMNAMAPT
SCHEMBL8540088 0.74 PSEN1 (0.46) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL2202154 0.74 CYP11B1 (0.40) SIRT2ALDH1A1LMNA
SCHEMBL8540763 0.72 PSEN1 (0.39) RECQLSRCHTR6PSEN1PSEN2
SCHEMBL8540756 0.72 PSEN1 (0.39) RECQLSRCHTR6PSEN1PSEN2
SCHEMBL8540560 0.72 PSEN1 (0.47) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL5688715 0.71 SIRT2 (0.40) SIRT2

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
EP-0820989-A1 IMIDAZOLE DERIVATIVES AND MEDICINAL COMPOSITION THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1998-01-28 EP disclosed