SCHEMBL4742408

SCHEMBL4742408

[CH2]CN1CCc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTTP P55157 13/20 0.58
APOB P04114 10/20 0.58
SMO Q99835 1/20 0.53
KDM4E B2RXH2 2/20 0.51
GAA P10253 2/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL8213608 0.91 MTTP (0.60) MTTPAPOBSMOKDM4EGAA
SCHEMBL8507709 0.91 MTTP (0.58) MTTPAPOBSMOKDM4EGAA
SCHEMBL8213404 0.91 MTTP (0.58) MTTPAPOBSMOKDM4EGAA
SCHEMBL8208665 0.90 MTTP (0.57) MTTPAPOBSMOKDM4EGAA
SCHEMBL8208323 0.90 APOB (0.58) MTTPAPOBSMOKDM4EGAA
SCHEMBL8208329 0.90 MTTP (0.57) MTTPAPOBSMOKDM4EGAA
SCHEMBL8506927 0.89 MTTP (0.59) MTTPAPOBSMOKDM4EGAA
SCHEMBL8210354 0.89 MTTP (0.56) MTTPAPOBSMOKDM4EGAA
SCHEMBL8200984 0.89 APOB (0.62) MTTPAPOBSMOKDM4EGAA
SCHEMBL8211067 0.89 MTTP (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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1996564-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES Pfizer Products Incorporated (US) 2008-12-03 EP disclosed
WO-2007105050-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-09-20 WO disclosed
WO-2007091140-A1 SUBSTITUTED PHENYLSULFAMOYL COMPOUNDS AS PPAR AGONISTS PFIZER PRODUCTS INC. (US) 2007-08-16 WO disclosed
WO-2006032987-A1 INDOLINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF ARTERIOSCLEROSIS PFIZER PRODUCTS INC. (US) 2006-03-30 WO disclosed