SCHEMBL8208061

SCHEMBL8208061

CNC(=O)NCCN1CCc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MTTP P55157 10/20 0.53
▸ APOB P04114 9/20 0.53
▸ SMO Q99835 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ GAA P10253 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 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
SCHEMBL691418 0.92 MTTP (0.59) MTTPAPOBSMOKDM4EGAA
Hydrochloric Acid SCHEMBL3887925 0.91 MTTP (0.59) MTTPAPOBSMOKDM4EGAA
Hydrochloric Acid SCHEMBL8408661 0.91 MTTP (0.59) MTTPAPOBSMOKDM4EGAA
SCHEMBL8213429 0.91 APOB (0.55) MTTPAPOBSMOKDM4EGAA
SCHEMBL8200807 0.90 MTTP (0.53) MTTPAPOBSMOKDM4EGAA
Hydrochloric Acid SCHEMBL8410108 0.90 MTTP (0.58) MTTPAPOBSMOKDM4EGAA
SCHEMBL8207484 0.90 MTTP (0.53) MTTPAPOBSMOKDM4EGAA
SCHEMBL692958 0.90 APOB (0.60) MTTPAPOBSMOKDM4EGAA
SCHEMBL8199883 0.90 APOB (0.61) MTTPAPOBSMOKDM4EGAA
SCHEMBL8206946 0.90 APOB (0.54) 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 4 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 claimed
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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