SCHEMBL8652127

SCHEMBL8652127

[CH2]c1ccc(NC(=O)CCCC(=O)O)cc1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.70
ALDH1A1 P00352 2/20 0.70
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
MAPT P10636 1/20 0.62
GAA P10253 3/20 0.59
L3MBTL1 Q9Y468 3/20 0.59
NPSR1 Q6W5P4 1/20 0.59
HSD17B10 Q99714 1/20 0.59
CYP1A1 P04798 1/20 0.56
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
CYP2C19 P33261 1/20 0.54
BCHE P06276 1/20 0.50
CASP3 P42574 1/20 0.50

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
SCHEMBL7107371 0.91 POLB (0.82) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL23521940 0.89 CYP1A1 (0.70) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL8585476 0.84 HDAC4 (0.70)
SCHEMBL3152473 0.84 CYP1A1 (0.79) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL3806017 0.83 MEN1 (0.73) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL1669619 0.82 ALDH1A1 (0.70) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL7109810 0.82 POLB (0.70) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL22773558 0.82 POLB (0.70) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL21788779 0.82 POLB (0.70) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL24040103 0.82 POLB (0.70) POLBALDH1A1MEN1KMT2AMAPT

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
US-5807688-A ANTIBODY DIRECTED ANZYME PRODRUG THERAPY ZENECA LIMITED (GB) 1998-09-15 US disclosed