SCHEMBL6638865

SCHEMBL6638865

Nc1cc(NC(=O)c2cc(C(F)(F)F)ccc2-c2ccccc2)ccc1NCc1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMO Q99835 3/20 0.53
SORT1 Q99523 1/20 0.50
MTTP P55157 2/20 0.46
APOB P04114 1/20 0.46
HTT P42858 2/20 0.44
BRAF P15056 1/20 0.44
LMNA P02545 1/20 0.44
RXFP1 Q9HBX9 2/20 0.43
ABL1 P00519 1/20 0.43
EGFR P00533 1/20 0.43
CSF1R P07333 1/20 0.43
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
FLT1 P17948 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 1/20 0.43
TRPV1 Q8NER1 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PTGS1 P23219 1/20 0.41

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
SCHEMBL6639807 0.91 SMO (0.49) SMOSORT1MTTPAPOBHTT
SCHEMBL6804592 0.90 SMO (0.64) SMOMTTPAPOBHTTLMNA
SCHEMBL6644487 0.90 SMO (0.48) SMOSORT1MTTPAPOBHTT
SCHEMBL6641215 0.86 SMO (0.50) SMOSORT1MTTPAPOBHTT
SCHEMBL6805454 0.82 SMO (0.60) SMOMTTPAPOBHTTLMNA
SCHEMBL7084308 0.81 SMO (0.49) SMOSORT1MTTPAPOBHTT
SCHEMBL7083387 0.81 SMO (0.49) SMOSORT1HTTLMNARXFP1
SCHEMBL7086991 0.80 SMO (0.48) SMOSORT1MTTPAPOBBRAF
SCHEMBL7176879 0.79 SMO (0.42) SMOABL1KDR
SCHEMBL6641308 0.78 PKM (0.51) SMOSORT1HTTLMNARXFP1

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-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 EP disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed