SCHEMBL6975613

SCHEMBL6975613

O=C(Nc1ccc2c(c1)CCNC2C(=O)Cc1ccccc1)Oc1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ APOB P04114 10/20 0.43
▸ MTTP P55157 10/20 0.43
▸ MGLL Q99685 2/20 0.42
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ F10 P00742 1/20 0.38
▸ SMO Q99835 2/20 0.38
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KDM1A O60341 1/20 0.36

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
SCHEMBL6974219 0.89 F10 (0.42) APOBMTTPMGLLF10SMO
SCHEMBL6964506 0.89 APOB (0.44) APOBMTTPMGLLSMO
SCHEMBL6973825 0.87 APOB (0.41) APOBMTTPMGLLF10SMO
SCHEMBL6967905 0.84 APOB (0.41) APOBMTTPMGLLF10GAA
SCHEMBL8472708 0.83 APOB (0.52) APOBMTTPSMOGAAMAPT
Xenalipin SCHEMBL9094220 0.78 MTTP (0.40) APOBMTTPRXRARXRBRXRG
SCHEMBL8025148 0.78 APOB (0.48) APOBMTTPSMO
SCHEMBL6974835 0.74 ABCB1 (0.48) APOBMTTPMGLLMAPT
SCHEMBL8206850 0.72 MTTP (0.58) APOBMTTPSMOGAAMAPT
SCHEMBL6974831 0.72 TMPRSS2 (0.42) APOBMTTP

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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