SCHEMBL6678100

SCHEMBL6678100

CCC1(C(F)(F)F)C=CC(c2ccccc2)C(C(=O)O)=C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CACNA1D Q01668 6/20 0.33
MDM2 Q00987 1/20 0.33
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
HDAC4 P56524 1/20 0.31

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
SCHEMBL6679547 0.80 HDAC4 (0.33) MDM2HDAC4
SCHEMBL6677869 0.80 CACNA1D (0.31) CACNA1DMDM2
SCHEMBL5614156 0.80 CACNA1D (0.33) CACNA1DHTR2AHTR2CHTR2B
SCHEMBL6678329 0.78 HDAC4 (0.31) HDAC4
SCHEMBL6678116 0.77
SCHEMBL6681681 0.77 HDAC4 (0.32) HDAC4
SCHEMBL6677067 0.76 CACNA1D (0.38) CACNA1D
SCHEMBL6677390 0.72 MEN1 (0.31) CACNA1DHTR2AHTR2CHTR2B
SCHEMBL4519520 0.71 CACNA1D (0.31) CACNA1D
SCHEMBL1170017 0.71 CACNA1D (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