SCHEMBL7956574

SCHEMBL7956574

Cc1cc(N2CCC(Oc3ccc(C(F)(F)F)cn3)C2)ncn1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.57
HRH3 Q9Y5N1 2/20 0.47
LIPE Q05469 8/20 0.46
ACACB O00763 2/20 0.43
HSD11B1 P28845 3/20 0.42
PIK3CD O00329 1/20 0.42
SCD O00767 1/20 0.42
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
RET P07949 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
SCHEMBL7961398 0.83 LIPG (0.57) LIPGHRH3LIPEACACBHSD11B1
SCHEMBL7947575 0.83 LIPG (0.57) LIPGHRH3LIPEHSD11B1SCD
SCHEMBL7956670 0.78 LIPG (0.52) LIPGHRH3LIPESCDRET
SCHEMBL26620366 0.78 LIPG (0.62) LIPGHRH3LIPEACACBHSD11B1
SCHEMBL29995167 0.78 LIPG (0.62) LIPGHRH3LIPEACACBHSD11B1
SCHEMBL23702994 0.78 LIPG (0.62) LIPGHRH3LIPEACACBHSD11B1
SCHEMBL29994537 0.78 LIPG (0.62) LIPGHRH3LIPEACACBHSD11B1
SCHEMBL23702850 0.78 LIPG (0.62) LIPGHRH3LIPEACACBHSD11B1
SCHEMBL7954969 0.78 LIPG (0.53) LIPGHRH3LIPESCDRET
SCHEMBL7956252 0.77 LIPG (0.60) LIPGHRH3LIPEHSD11B1SCD

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