SCHEMBL8359154

SCHEMBL8359154

O=C(NCc1ccncc1)OC1Cc2ccccc2N(S(=O)(=O)c2ccc(Cl)cc2)C1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 3/20 0.60
▸ PSEN2 P49810 3/20 0.60
▸ APH1B Q8WW43 3/20 0.60
▸ NCSTN Q92542 3/20 0.60
▸ APH1A Q96BI3 3/20 0.60
▸ PSENEN Q9NZ42 3/20 0.60
▸ NAMPT P43490 5/20 0.46
▸ PAX8 Q06710 1/20 0.45
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MCL1 Q07820 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ CMA1 P23946 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL8359168 0.90 NAMPT (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2152559 0.86 ALDH1A1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8359141 0.82 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8359136 0.78 APP (0.59) MEN1KMT2ACYP2D6
SCHEMBL12463056 0.77 MCL1 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8359140 0.77 MEN1 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12462828 0.75 PSEN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8359145 0.75 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2152553 0.74 MCL1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8354520 0.73 MEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A

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-1492765-B1 NOVEL GAMMA SECRETASE INHIBITORS SCHERING CORP (US) 2011-07-06 — — EP disclosed
WO-2003014075-A2 NOVEL GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2003-02-20 — — WO disclosed
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