SCHEMBL6644487

SCHEMBL6644487

Nc1cc(NC(=O)c2cc(C(F)(F)F)ccc2-c2ccccc2)ccc1NCCCc1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMO Q99835 3/20 0.48
▸ SORT1 Q99523 1/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MTTP P55157 2/20 0.42
▸ APOB P04114 1/20 0.42
▸ TRPV1 Q8NER1 2/20 0.40
▸ NTRK1 P04629 1/20 0.40
▸ TRPV4 Q9HBA0 1/20 0.40
▸ LRRK2 Q5S007 2/20 0.39
▸ PTGS1 P23219 1/20 0.39

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 0.95 SMO (0.49) SMOSORT1RXFP1MEN1ALDH1A1
SCHEMBL6638865 0.90 SMO (0.53) SMOSORT1RXFP1ALDH1A1LMNA
SCHEMBL6643055 0.87 SMO (0.46) SMOSORT1RXFP1MEN1ALDH1A1
SCHEMBL6805454 0.86 SMO (0.60) SMORXFP1MEN1ALDH1A1LMNA
SCHEMBL7083387 0.85 SMO (0.49) SMOSORT1RXFP1MEN1ALDH1A1
SCHEMBL7084308 0.85 SMO (0.49) SMOSORT1RXFP1MEN1ALDH1A1
SCHEMBL7176879 0.83 SMO (0.42) SMOMEN1MAPTKMT2A
SCHEMBL7087226 0.83 SMO (0.49) SMOSORT1RXFP1MEN1ALDH1A1
SCHEMBL6641308 0.82 PKM (0.51) SMOSORT1RXFP1MEN1ALDH1A1
SCHEMBL6638338 0.81 S1PR1 (0.43) SMORXFP1MEN1ALDH1A1LMNA

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
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