SCHEMBL8200795

SCHEMBL8200795

O=C(CN1CCc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1)NCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTTP P55157 15/20 0.61
APOB P04114 9/20 0.61
SMO Q99835 2/20 0.49
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL8227337 0.90 APOB (0.56) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8208323 0.89 APOB (0.58) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8200800 0.88 MTTP (0.56) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8200984 0.88 APOB (0.62) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8208665 0.87 MTTP (0.57) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6963061 0.87 MTTP (0.63) MTTPAPOBSMO
SCHEMBL8508887 0.87 APOB (0.60) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8206849 0.87 APOB (0.60) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8211067 0.87 MTTP (0.61) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8213181 0.86 APOB (0.59) MTTPAPOBSMOKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6121283-A Apo B-secretion/MTP inhibitory amides PFIZER INC (US) 2000-09-19 US disclosed
EP-0944602-A1 APO B-SECRETION/MTP INHIBITORY AMIDES PFIZER INC. (US) 1999-09-29 EP disclosed
WO-1998023593-A1 APO B-SECRETION/MTP INHIBITORY AMIDES PFIZER INC. (US) 1998-06-04 WO disclosed