SCHEMBL6136737

SCHEMBL6136737

CC(NC(=O)Cc1ccc2ccccc2c1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
NLRP3 Q96P20 1/20 0.51
RIOK2 Q9BVS4 3/20 0.50
GSK3A P49840 2/20 0.50
MAPK10 P53779 2/20 0.50
MAPK8 P45983 1/20 0.50
HIPK1 Q86Z02 1/20 0.50
SNRK Q9NRH2 1/20 0.50
SDCBP O00560 1/20 0.50
SDC2 P34741 1/20 0.50
ELANE P08246 1/20 0.50
MME P08473 1/20 0.50
ACE P12821 1/20 0.50
CPA1 P15085 1/20 0.50
ACE2 Q9BYF1 1/20 0.50
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49

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
SCHEMBL6136739 1.00 NR1H4 (0.56) NR1H4L3MBTL1MEN1KMT2ANLRP3
SCHEMBL16312240 0.85 ELANE (0.54) NR1H4L3MBTL1MEN1KMT2ANLRP3
SCHEMBL2177216 0.84 POLB (0.63) MEN1KMT2AALDH1A1CNR2
SCHEMBL2177223 0.84 POLB (0.63) MEN1KMT2AALDH1A1CNR2
SCHEMBL8035990 0.84 POLB (0.63) MEN1KMT2AALDH1A1CNR2
SCHEMBL6136552 0.84 MME (0.58) NR1H4L3MBTL1MEN1KMT2ANLRP3
SCHEMBL14688070 0.83 RECQL (0.54) NR1H4L3MBTL1MEN1KMT2ANLRP3
SCHEMBL6136338 0.82 RECQL (0.53) NR1H4L3MBTL1MEN1KMT2ANLRP3
SCHEMBL4415369 0.82 RECQL (0.53) NR1H4L3MBTL1MEN1KMT2ANLRP3
SCHEMBL22764712 0.82 MME (0.64) NR1H4MEN1KMT2AMMEACE

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
EP-0951464-B1 N-(ARYL/HETEROARYLACETYL) AMINO ACID ESTERS, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARM INC (US) 2005-05-11 EP claimed