SCHEMBL27738280

SCHEMBL27738280

NC(=O)CC[C@H](C(=O)O)N(C(=O)OCC1c2ccccc2-c2ccccc21)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
FABP5 Q01469 3/20 0.38
FABP7 O15540 2/20 0.38
MDM4 O15151 2/20 0.36
TP53 P04637 2/20 0.36
EPHX2 P34913 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CASP3 P42574 2/20 0.34
MDM2 Q00987 1/20 0.34
TLR2 O60603 1/20 0.33
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL29875681 1.00 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL5501054 1.00 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL25322549 1.00 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL28863857 0.92 KMT2A (0.44) KMT2AFABP5FABP7MDM4TP53
SCHEMBL28863858 0.92 KMT2A (0.44) KMT2AFABP5FABP7MDM4TP53
SCHEMBL29397011 0.89 KMT2A (0.40) KMT2AFABP5FABP7MDM4TP53
SCHEMBL30112800 0.89 KMT2A (0.40) KMT2AFABP5FABP7MDM4TP53
SCHEMBL21581904 0.89 KMT2A (0.40) KMT2AFABP5FABP7MDM4TP53
SCHEMBL4096877 0.89 KMT2A (0.40) KMT2AFABP5FABP7MDM4TP53
SCHEMBL29875636 0.89 KMT2A (0.40) KMT2AFABP5FABP7MDM4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114163354-B Preparation method of N-fluorenylmethoxycarbonyl-N-trityl-L-asparagine 常州吉恩药业有限公司 2023-05-05 CN disclosed
CN-100593536-C Method for synthesizing N-fluorene methoxycarbonyl-N-trityl-D-glutamine GL BIOCHEM SHANGHAI LTD 2010-03-10 CN disclosed
CN-101219970-A Method for synthesizing N-fluorene methoxycarbonyl-N-trityl-D-glutamine GL BIOCHEM SHANGHAI LTD (CN) 2008-07-16 CN disclosed