SCHEMBL6901054

SCHEMBL6901054

CC([C@H](C(=O)Nc1cc(C[C@@H](C)C(=O)O)ccc1Cl)c1ccc(Cl)cc1)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TRPV1 Q8NER1 1/20 0.42
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
FFAR2 O15552 5/20 0.38
LMNA P02545 1/20 0.37
HTRA1 Q92743 1/20 0.36

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
SCHEMBL6903201 1.00 L3MBTL1 (0.45) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL1932640 1.00 L3MBTL1 (0.45) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL1908272 1.00 L3MBTL1 (0.45) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL12535983 1.00 L3MBTL1 (0.45) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL1930517 0.93 L3MBTL1 (0.38) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL1931896 0.93 L3MBTL1 (0.38) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL1932195 0.93 L3MBTL1 (0.38) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL6902520 0.93 SMN1; SMN2 (0.39) L3MBTL1MEN1KMT2ATRPV1SMN1; SMN2
SCHEMBL1905649 0.92 SMN1; SMN2 (0.37) L3MBTL1MEN1KMT2ATRPV1PDK1
SCHEMBL1932604 0.92 FFAR4 (0.39) L3MBTL1MEN1KMT2AFFAR2

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-2011051165-A1 SUBSTITUTED 3-PHENYLPROPIONIC ACIDS AND THE USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-05 WO disclosed