SCHEMBL8587342

SCHEMBL8587342

CC(C)(C)OC(=O)N1CCc2cc(NC(=O)c3cc(C(F)(F)F)ccc3-c3ccccc3)ccc2C1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APOB P04114 11/20 0.52
MTTP P55157 10/20 0.52
JAK2 O60674 2/20 0.51
JAK3 P52333 2/20 0.51
PTK2 Q05397 2/20 0.51
ESR2 Q92731 1/20 0.48
TMPRSS2 O15393 1/20 0.46
NAMPT P43490 1/20 0.45
RAF1 P04049 1/20 0.45
BRAF P15056 1/20 0.45
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL6974148 0.91 MTTP (0.59) APOBMTTPJAK2JAK3PTK2
SCHEMBL9232371 0.86 NAMPT (0.52) APOBMTTPTMPRSS2NAMPT
SCHEMBL8470621 0.81 APOB (0.47) APOBMTTPTMPRSS2
SCHEMBL8200962 0.81 MTTP (0.52) APOBMTTPJAK2JAK3PTK2
SCHEMBL8591888 0.81 SMO (0.46) APOBMTTPTMPRSS2NAMPT
SCHEMBL6969150 0.81 UCHL1 (0.56) APOBMTTPJAK2JAK3PTK2
SCHEMBL1187947 0.81 ESR2 (0.58) JAK2JAK3PTK2ESR2NAMPT
SCHEMBL8207493 0.81 ITGB3 (0.55) APOBMTTPTMPRSS2
SCHEMBL14585872 0.80 MTTP (0.54) APOBMTTPJAK2JAK3PTK2
SCHEMBL7806887 0.80 NAMPT (0.56) APOBMTTPJAK2JAK3PTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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