SCHEMBL11487482

SCHEMBL11487482

CC(=O)NN1C(=O)CC1CN.c1cc2cc-2c1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GRIA2 P42262 2/20 0.32
AOC3 Q16853 2/20 0.32
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
BACE1 P56817 1/20 0.31
KLK7 P49862 1/20 0.31
ADAMTS4 O75173 1/20 0.31
LMNA P02545 1/20 0.31
ITGB1 P05556 1/20 0.31
ITGA4 P13612 1/20 0.31
LARS1 Q9P2J5 1/20 0.31

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
SCHEMBL10890403 0.88 BRD4 (0.36) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL10542287 0.85 MTNR1A (0.38) ITGB1
SCHEMBL11363297 0.85 KMT2A (0.32) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL10884861 0.80 ALDH1A1 (0.35) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL8014019 0.79 KDM4E (0.38) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL8019417 0.79 KDM4E (0.38) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL11538730 0.77 KMT2A (0.34) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL11542905 0.76 ALDH1A1 (0.32) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL8604220 0.76 KLK7 (0.33) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL9443885 0.76 MEN1 (0.35) KMT2AMEN1ALDH1A1KDM4EHPGD

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-4200572-A Substituted azetidinones SMITHKLINE CORPORATION (US) 1980-04-29 US disclosed