SCHEMBL6974219

SCHEMBL6974219

O=C(Nc1ccc2c(c1)CCNC2C(=O)COc1ccccc1)Oc1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.42
▸ APOB P04114 9/20 0.39
▸ MTTP P55157 8/20 0.39
▸ MGLL Q99685 2/20 0.38
▸ SMO Q99835 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 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
SCHEMBL6964506 0.91 APOB (0.44) APOBMTTPMGLLSMO
SCHEMBL6973825 0.89 APOB (0.41) F10APOBMTTPMGLLSMO
SCHEMBL6975613 0.89 APOB (0.43) F10APOBMTTPMGLLSMO
SCHEMBL6967905 0.83 APOB (0.41) F10APOBMTTPMGLLMAPT
SCHEMBL8025148 0.76 APOB (0.48) APOBMTTPSMO
SCHEMBL8472708 0.74 APOB (0.52) APOBMTTPSMOMAPTLMNA
SCHEMBL6973488 0.70 TSHR (0.44) MAPTHTTNPSR1GAA
SCHEMBL6974835 0.70 ABCB1 (0.48) APOBMTTPMGLLMAPTLMNA
SCHEMBL6967435 0.70 APOB (0.41) APOBMTTPSMOMAPTGAA
SCHEMBL6973499 0.69 SMO (0.45) APOBMTTPSMO

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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