SCHEMBL4884635

SCHEMBL4884635

CN(Cc1ccc(F)cc1)C(=O)C(NC(=O)C12CCC(CC1)CC2)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
MTTP P55157 14/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL14102276 1.00 TDP1 (0.56) TDP1MTTPMEN1KMT2A
SCHEMBL4939844 0.82 TDP1 (0.69) TDP1MTTPMEN1KMT2A
SCHEMBL14046234 0.78 TDP1 (0.71) TDP1MTTPMEN1KMT2A
SCHEMBL14046208 0.78 TDP1 (0.59) TDP1MTTPMEN1KMT2A
SCHEMBL14028030 0.76 MTTP (0.58) TDP1MTTP
SCHEMBL4788125 0.75 TDP1 (0.59) TDP1MTTPMEN1KMT2A
SCHEMBL4941179 0.75 TDP1 (0.59) TDP1MTTPMEN1KMT2A
SCHEMBL4938920 0.75 MTTP (0.59) MTTP
SCHEMBL4938915 0.75 MTTP (0.59) MTTP
SCHEMBL4940392 0.74 MTTP (0.58) MTTP

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008100423-A1 GUT MICROSOMAL TRIGLYCERIDE TRANSPORT PROTEIN INHIBITORS SIRTRIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO disclosed