SCHEMBL8809151

SCHEMBL8809151

Clc1ccc(N(Cc2ccccc2)C2CCCCCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGER Q15109 3/20 0.57
SLC6A2 P23975 6/20 0.49
SLC6A4 P31645 6/20 0.49
SLC6A3 Q01959 6/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
G6PC1 P35575 1/20 0.48
S1PR1 P21453 1/20 0.47
REN P00797 2/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
NOS2 P35228 1/20 0.42
CYP1A2 P05177 1/20 0.42
DRD2 P14416 1/20 0.41

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
SCHEMBL4476467 0.92 G6PC1 (0.54) AGERSLC6A2SLC6A4SLC6A3G6PC1
SCHEMBL10891206 0.89 G6PC1 (0.50) AGERSLC6A2SLC6A4SLC6A3CYP3A4
SCHEMBL8806703 0.84 G6PC1 (0.48) AGERSLC6A2SLC6A4SLC6A3G6PC1
SCHEMBL9057640 0.84 CYP2C19 (0.53) SLC6A2SLC6A4SLC6A3CYP2C19G6PC1
SCHEMBL28104378 0.84 G6PC1 (0.48) AGERSLC6A2SLC6A4SLC6A3CYP3A4
SCHEMBL9057596 0.84 AGER (0.57) AGERSLC6A2SLC6A4SLC6A3G6PC1
SCHEMBL6553676 0.81 G6PC1 (0.44) AGERSLC6A2SLC6A4SLC6A3CYP3A4
SCHEMBL11504078 0.80 CYP2D6 (0.55) AGERSLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL4306682 0.79 NOS2 (0.62) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL2931103 0.76 REN (0.66) AGERSLC6A2SLC6A4SLC6A3CYP3A4

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-0784612-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-23 EP disclosed
WO-1996010559-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-11 WO disclosed