SCHEMBL7748966

SCHEMBL7748966

CC(C)CNC(=O)C(C)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.55
ERCC4 Q92889 1/20 0.55
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
GRM7 Q14831 2/20 0.49
POLB P06746 2/20 0.49
HPGD P15428 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.46
APAF1 O14727 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
GPR88 Q9GZN0 2/20 0.46

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
SCHEMBL13059171 0.90 PTGS2 (0.59) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL17307874 0.89 ERCC1 (0.55) ERCC1ERCC4KMT2AMEN1GRM7
SCHEMBL15709156 0.85 CNR1 (0.59) KMT2AMEN1ALDH1A1MAPTPOLB
SCHEMBL13765364 0.84 NAAA (0.58) KMT2AMEN1ALDH1A1MAPTPOLB
SCHEMBL10138151 0.83 PKM (0.58) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL19523017 0.83 PKM (0.58) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL4214155 0.82 KMT2A (0.50) KMT2AMEN1ALDH1A1MAPTPOLB
SCHEMBL4989142 0.82 KMT2A (0.50) KMT2AMEN1ALDH1A1MAPTPOLB
SCHEMBL6784092 0.82 CHRM1 (0.50) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL9828973 0.82 ERCC1 (0.49) ERCC1ERCC4GRM7POLBGPR88

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480941-B1 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS AMBRILIA BIOPHARMA INC (CA) 2011-01-26 EP disclosed
US-6528532-B1 Benzenesulfonamide group PHARMACOR INC. (CA) 2003-03-04 US disclosed