SCHEMBL6966432

SCHEMBL6966432

CC(c1ncc[nH]1)N1CCc2cc(NC(=O)Oc3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ APOB P04114 10/20 0.40
▸ MTTP P55157 9/20 0.40
▸ FPR2 P25090 3/20 0.40
▸ SMO Q99835 1/20 0.38
▸ C5AR1 P21730 1/20 0.36
▸ PRMT5 O14744 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35

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
SCHEMBL6970470 0.87 MTTP (0.42) APOBMTTPFPR2
SCHEMBL6966580 0.82 SCN9A (0.43) APOBMTTPSMOPRMT5WDR77
SCHEMBL6969570 0.79 NPC1 (0.48) APOBMTTPSMO
SCHEMBL6962760 0.79 APOB (0.44) APOBMTTP
SCHEMBL6973499 0.79 SMO (0.45) APOBMTTPSMO
SCHEMBL6974662 0.78 EPHX2 (0.45) APOBMTTP
SCHEMBL6970162 0.77 NAMPT (0.47) APOBMTTP
SCHEMBL6964489 0.77 SMO (0.50) APOBMTTPSMO
SCHEMBL6965865 0.77 APOB (0.41) APOBMTTPSMO
SCHEMBL6967435 0.76 APOB (0.41) APOBMTTPSMOPRMT5WDR77

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
EP-0832069-B1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER (US) 2003-03-05 — — EP claimed
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