SCHEMBL7640992

SCHEMBL7640992

CCOC(=O)Cn1cc(C)c(=O)n(COCc2ccccc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 2/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP3A4 P08684 1/20 0.44
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 3/20 0.42
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL7872863 0.88 ALDH1A1 (0.43) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL24666581 0.79 ALDH1A1 (0.48) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL20012332 0.77 ALDH1A1 (0.42) MEN1KMT2AALDH1A1L3MBTL1RAB9A
SCHEMBL26271105 0.73 KMT2A (0.45) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL13377767 0.73 ALDH1A1 (0.35) MEN1KMT2AALDH1A1
SCHEMBL13460706 0.73 ALDH1A1 (0.35) MEN1KMT2AALDH1A1
SCHEMBL13377755 0.72 ALDH1A1 (0.36) MEN1KMT2AALDH1A1
SCHEMBL6283595 0.71 L3MBTL1 (0.50) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL14278239 0.71 CNR2 (0.34) MEN1KMT2AALDH1A1
SCHEMBL21522983 0.71 RAB9A (0.46) MEN1KMT2AALDH1A1KDM4EL3MBTL1

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
US-6465650-B1 INTERMEDIATE STEPS IN PREPARING PEPTIDE NUCLEIC ACIDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-10-15 US disclosed
US-6316595-B1 PNA synthesis using a base-labile amino protecting group AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-11-13 US disclosed
US-6075143-A USEFUL FOR FORMING PEPTIDE NUCLEIC ACIDS OR HYBRID OF PEPTIDE NUCLEIC ACIDS AND DEOXYNUCLEIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 2000-06-13 US disclosed