SCHEMBL6640573

SCHEMBL6640573

Cc1cc(-c2ccccc2)c(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.52
MEN1 O00255 9/20 0.52
KMT2A Q03164 9/20 0.52
MAPT P10636 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
HTT P42858 2/20 0.52
ALDH1A1 P00352 3/20 0.50
POLB P06746 1/20 0.50
TP53 P04637 2/20 0.48
MCL1 Q07820 1/20 0.47
RAB9A P51151 2/20 0.45
RECQL P46063 1/20 0.44
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
P2RX1 P51575 1/20 0.44
NPC1 O15118 1/20 0.44
MAPK1 P28482 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44

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
SCHEMBL6677407 0.86 MAPT (0.51) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6638787 0.83 LMNA (0.55) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6640445 0.79 MAPT (0.49) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL6683660 0.79 S1PR1 (0.48) LMNAS1PR1S1PR3
SCHEMBL6677363 0.78 NPC1 (0.48) LMNAKMT2AMAPTSMN1; SMN2POLB
SCHEMBL6801792 0.78 TP53 (0.56) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6488558 0.77 LMNA (0.50) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1408451 0.76 MEN1 (0.62) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5900771 0.76 MEN1 (0.65) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1380611 0.75 LMNA (0.51) LMNAMEN1KMT2AMAPTSMN1; SMN2

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-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 WO disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed