SCHEMBL5236432

SCHEMBL5236432

[NH]C(=O)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1CCCCc1nnn[nH]1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.38
NR1H3 Q13133 19/20 0.32
NR1H2 P55055 18/20 0.32

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
SCHEMBL5232968 0.74 MLYCD (0.52) MLYCD
SCHEMBL5232984 0.73 NR1H3 (0.38) MLYCDNR1H3NR1H2
SCHEMBL2942525 0.72 MLYCD (0.69) MLYCD
SCHEMBL2943323 0.66 MLYCD (0.68) MLYCDNR1H3NR1H2
SCHEMBL2705361 0.63 L3MBTL1 (0.32)
SCHEMBL13411814 0.62 L3MBTL1 (0.36)
SCHEMBL16752719 0.62 L3MBTL1 (0.36)
SCHEMBL16752678 0.62 L3MBTL1 (0.36)
SCHEMBL10641491 0.62 L3MBTL1 (0.36)
SCHEMBL10435516 0.60 TBXAS1 (0.47)

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
EP-1353662-B1 METHODS FOR THE TREATMENT OF DISEASES USING MALONYL-COA DECARBOX YLASE INHIBITORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2007-04-18 EP claimed