SCHEMBL628935

SCHEMBL628935

CSCC[C@H](Nc1ccc(CN(C)CCC2=CCCCC2)cc1-c1ccccc1C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
FNTA P49354 4/20 0.45
FNTB P49356 4/20 0.45

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
SCHEMBL628433 0.88 FNTA (0.59) FNTAFNTB
SCHEMBL630026 0.82 FNTA (0.54) FNTAFNTB
SCHEMBL628444 0.78 NPSR1 (0.40)
SCHEMBL628801 0.76 L3MBTL1 (0.41) SMN1; SMN2
SCHEMBL7874204 0.75 FNTA (0.58) FNTAFNTB
SCHEMBL629703 0.73 FNTA (0.79) FNTAFNTB
SCHEMBL7874240 0.73 FNTA (0.67) FNTAFNTB
SCHEMBL629100 0.70 FNTA (0.80) FNTAFNTB
SCHEMBL629061 0.70 FNTA (0.80) FNTAFNTB
SCHEMBL628794 0.70 FNTA (0.79) FNTAFNTB

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-0986384-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2012-02-22 EP disclosed