SCHEMBL6677869

SCHEMBL6677869

CC1(C(F)(F)F)C=CC(c2ccccc2)C(C(=O)O)=C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CACNA1D Q01668 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
MDM2 Q00987 1/20 0.30

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
SCHEMBL6678329 0.81 HDAC4 (0.31)
SCHEMBL6679547 0.81 HDAC4 (0.33) MDM2
SCHEMBL6681681 0.80 HDAC4 (0.32)
SCHEMBL6678100 0.80 CACNA1D (0.33) CACNA1DMDM2
SCHEMBL6680769 0.78 SLC9A1 (0.34) CACNA1DHCRTR1HCRTR2
SCHEMBL6678116 0.78
SCHEMBL6679649 0.77 CACNA1D (0.35) CACNA1DHCRTR1HCRTR2
SCHEMBL6639930 0.77 KIF11 (0.32) CACNA1D
SCHEMBL6677411 0.75 ATM (0.33) CACNA1D
SCHEMBL6677390 0.75 MEN1 (0.31) CACNA1D

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