SCHEMBL1492849

SCHEMBL1492849

Cc1cc(-c2ccc(NC(=O)NCCc3ccccc3C)cc2)ccn1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 3/20 0.55
ROCK2 O75116 1/20 0.53
ROCK1 Q13464 1/20 0.53
PSEN1 P49768 10/20 0.52
PSEN2 P49810 10/20 0.52
APH1B Q8WW43 10/20 0.52
NCSTN Q92542 10/20 0.52
APH1A Q96BI3 10/20 0.52
PSENEN Q9NZ42 10/20 0.52
PORCN Q9H237 2/20 0.52
CNR1 P21554 1/20 0.49
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL1492982 0.90 CNR1 (0.63) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1492868 0.89 WNT3A (0.53) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1492922 0.89 CNR1 (0.60) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1493072 0.87 CNR1 (0.63) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1493027 0.83 CNR1 (0.69) WNT3APSEN1PSEN2APH1BNCSTN
SCHEMBL1493021 0.82 CNR1 (0.60) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1492661 0.82 WNT3A (0.57) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1492651 0.81 PSEN1 (0.69) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1492815 0.81 PSEN1 (0.51) WNT3AROCK2ROCK1PSEN1PSEN2
SCHEMBL1492731 0.81 PSEN1 (0.53) WNT3APSEN1PSEN2APH1BNCSTN

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-2300427-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2011-03-30 EP claimed
WO-2009137404-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-11-12 WO claimed