SCHEMBL8227639

SCHEMBL8227639

O=C(Nc1ccc2c(c1)CCN(C1CCN(C(=O)C(F)(F)F)CC1)C2)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MTTP P55157 14/20 0.55
▸ APOB P04114 13/20 0.55
▸ SMO Q99835 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL8207711 0.92 MTTP (0.59) MTTPAPOBSMOKDM4EGAA
SCHEMBL8208142 0.91 APOB (0.60) MTTPAPOBSMOKDM4EGAA
SCHEMBL8208363 0.91 MTTP (0.57) MTTPAPOBSMOKDM4EGAA
SCHEMBL8507710 0.90 APOB (0.59) MTTPAPOBSMOKDM4EGAA
SCHEMBL8207614 0.90 MTTP (0.53) MTTPAPOBSMOKDM4EGAA
SCHEMBL8208177 0.89 APOB (0.56) MTTPAPOBSMOKDM4EGAA
SCHEMBL8199847 0.89 APOB (0.56) MTTPAPOBSMOKDM4EGAA
SCHEMBL8508125 0.87 APOB (0.67) MTTPAPOBSMOKDM4EGAA
SCHEMBL8207798 0.86 APOB (0.58) MTTPAPOBSMOKDM4EGAA
SCHEMBL6966884 0.82 APOB (0.61) MTTPAPOBSMOKDM4EGAA

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
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