SCHEMBL7954744

SCHEMBL7954744

Clc1ccc(OC2CCN(c3ccncc3)C2)nc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.43
PROKR1 Q8TCW9 1/20 0.43
ACACB O00763 7/20 0.41
MMP1 P03956 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
KCNH2 Q12809 1/20 0.39
F10 P00742 3/20 0.39
HRH3 Q9Y5N1 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL7956692 0.92 FPR2 (0.47) FPR2PROKR1MMP1KCNH2F10
SCHEMBL7957015 0.85 ACACB (0.41) ACACBLIPGHRH3HCRTR1HCRTR2
SCHEMBL7947301 0.85 ACACB (0.41) ACACBLIPGHRH3HCRTR1HCRTR2
SCHEMBL5632542 0.85 ACACB (0.43) ACACBLIPGHRH3
SCHEMBL7961553 0.85 ACACB (0.41) ACACBLIPGHRH3HCRTR1HCRTR2
SCHEMBL7961497 0.81 LIPG (0.60) LIPGHRH3
SCHEMBL7956252 0.81 LIPG (0.60) LIPGHRH3
SCHEMBL7956524 0.81 LIPG (0.60) LIPGHRH3
SCHEMBL7956682 0.81 ACACB (0.43) ACACBLIPGHRH3
SCHEMBL7956662 0.81 ACACB (0.55) ACACBKCNH2HRH3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6313127-B1 FOR THERAPY OF HYPERCHOLESTEROLEMIA OR ATHEROSCLEROSIS ZENECA LIMITED (GB) 2001-11-06 US disclosed