SCHEMBL1492664

SCHEMBL1492664

Cc1cc(-c2ccc(NC(=O)NCCc3cccc(Br)c3)cc2)ccn1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.62
ROCK2 O75116 2/20 0.56
ROCK1 Q13464 1/20 0.56
PSEN1 P49768 7/20 0.55
PSEN2 P49810 7/20 0.55
APH1B Q8WW43 7/20 0.55
NCSTN Q92542 7/20 0.55
APH1A Q96BI3 7/20 0.55
PSENEN Q9NZ42 7/20 0.55
WNT3A P56704 4/20 0.52
KIT P10721 1/20 0.48
PDGFRA P16234 1/20 0.48
KDR P35968 1/20 0.48
PORCN Q9H237 2/20 0.48

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
SCHEMBL1492651 0.89 PSEN1 (0.69) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL7964831 0.89 ROCK2 (0.58) ROCK2ROCK1PSEN1PSEN2APH1B
SCHEMBL1492676 0.88 CNR1 (0.58) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL1492760 0.88 CNR1 (0.66) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL1492711 0.88 CNR1 (0.62) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL1492653 0.87 PSEN1 (0.51) CNR1ROCK2PSEN1PSEN2APH1B
SCHEMBL1492960 0.86 CNR1 (0.66) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL1492800 0.85 CNR1 (0.64) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL1493021 0.84 CNR1 (0.60) CNR1ROCK2ROCK1PSEN1PSEN2
SCHEMBL1492661 0.83 WNT3A (0.57) CNR1ROCK2ROCK1PSEN1PSEN2

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 4 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
EP-2300427-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2011-03-30 EP disclosed
WO-2009137404-A1 UREA COMPOUNDS AS GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-11-12 WO disclosed