SCHEMBL28067040

SCHEMBL28067040

CC(C)(C)OC(=O)NOC(=O)CC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
CYP3A4 P08684 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
CES1 P23141 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
PPARG P37231 4/20 0.43
PPARA Q07869 4/20 0.43
PPARD Q03181 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43

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
SCHEMBL768486 0.84 KMT2A (0.57) KMT2AMEN1CYP3A4HPGDKDM4E
SCHEMBL1948795 0.81 ALDH1A1 (0.58) KMT2AMEN1MAPTTDP1NPC1
SCHEMBL1948655 0.80 CA12 (0.50) MAPK1SMN1; SMN2PPARGPPARACA12
SCHEMBL11910716 0.78 KMT2A (0.50) KMT2AMEN1CYP3A4HPGDKDM4E
SCHEMBL3218996 0.78 L3MBTL1 (0.42) KMT2AMEN1CYP3A4HPGDKDM4E
SCHEMBL3786555 0.78 TDP1 (0.50) KMT2ATDP1PPARGPPARACA12
SCHEMBL941121 0.76 JAK3 (0.48) KMT2AMEN1CYP3A4HPGDKDM4E
SCHEMBL27316994 0.76 MAPT (0.55) KMT2AMEN1CYP3A4HPGDKDM4E
SCHEMBL17844769 0.75 ADRB2 (0.49) KMT2AMAPK1SMN1; SMN2TDP1CA12
SCHEMBL28829142 0.75 CTSK (0.45) MAPTPPARGPPARAPPARDCA12

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-109867630-A - 1 receptor modulators of novel glp-1 赛尔基因第二国际有限公司 2019-06-11 CN disclosed
CN-105593225-B novel GLP-1 receptor modulators 赛尔基因第二国际有限公司 2019-04-16 CN disclosed
CN-105593225-A Novel GLP-1 receptor modulators RECEPTOS INC 2016-05-18 CN disclosed