SCHEMBL6091970

SCHEMBL6091970

CN(C)C(CCOC(=O)NCc1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.59
CHRNB2 P17787 2/20 0.53
CHRNB4 P30926 2/20 0.53
CHRNA3 P32297 2/20 0.53
CHRNA4 P43681 2/20 0.53
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
OPRM1 P35372 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
SCHEMBL6090694 0.78 UTS2R (0.60) UTS2RCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6091146 0.78 UTS2R (0.53) UTS2RCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6091406 0.78 UTS2R (0.62) UTS2RCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6092440 0.76 UTS2R (0.62) UTS2RCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5455926 0.74 UTS2R (1.00) UTS2R
SCHEMBL27558012 0.74 CHRNB2 (0.48) CHRNB2CHRNB4CHRNA3CHRNA4LMNA
SCHEMBL6092762 0.74 UTS2R (0.60) UTS2RALDH1A1LMNATP53
SCHEMBL28071194 0.73 PLAU (0.64) LMNA
SCHEMBL14064867 0.73 CHRM1 (0.54) UTS2RCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6092713 0.73 UTS2R (0.61) UTS2RCHRNB2CHRNB4CHRNA3CHRNA4

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
WO-2006135694-A2 UII-MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2006-12-21 WO claimed
WO-2006135694-A2 UII-MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2006-12-21 WO disclosed