SCHEMBL6376512

SCHEMBL6376512

[CH2][C@H](C)c1ccc(-c2ccc(CCNS(C)(=O)=O)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 6/20 0.65
POLB P06746 1/20 0.44
LSS P48449 1/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
ALOX15 P16050 1/20 0.38
CA5A P35218 1/20 0.38
CA14 Q9ULX7 1/20 0.38
F10 P00742 3/20 0.38
PRSS1 P07477 3/20 0.38
PRSS2 P07478 3/20 0.38
PRSS3 P35030 3/20 0.38
NQO2 P16083 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL4944741 1.00 GRIA4 (0.65) GRIA4POLBLSSALDH1A1MEN1
SCHEMBL5991959 0.85 GRIA4 (0.63) GRIA4POLBLSSALDH1A1MEN1
SCHEMBL12076289 0.82 GRIA4 (0.70) GRIA4POLBALDH1A1MEN1KMT2A
SCHEMBL8199627 0.80 GRIA4 (0.70) GRIA4POLBALDH1A1MEN1KMT2A
Mibampator SCHEMBL6660037 0.79 GRIA4 (1.00) GRIA4POLB
Mibampator SCHEMBL3045499 0.79 GRIA4 (1.00) GRIA4POLB
Mibampator SCHEMBL3074747 0.79 GRIA4 (1.00) GRIA4POLB
SCHEMBL10312250 0.79 POLB (0.64) GRIA4POLBALDH1A1MEN1KMT2A
SCHEMBL15663101 0.77 GRIA4 (0.62) GRIA4POLBALDH1A1MEN1KMT2A
SCHEMBL6784069 0.76 GRIA4 (0.68) GRIA4MEN1KMT2ACA12CA1

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-1294683-B1 A PROCESS FOR PREPARING BIPHENYL COMPOUNDS LILLY CO ELI (US) 2005-11-30 EP disclosed