SCHEMBL29480784

SCHEMBL29480784

COC(C)Cn1cnc2ccc(C(=O)O)nc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.39
MAPK14 Q16539 4/20 0.36
KDM4E B2RXH2 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
PABPC1 P11940 1/20 0.34
KMT2A Q03164 1/20 0.34
MCL1 Q07820 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
CYP3A4 P08684 1/20 0.33
AGER Q15109 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
ADRA1A P35348 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
MAPK1 P28482 1/20 0.32
MGAM O43451 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
SCHEMBL30538783 0.79 MEN1 (0.43) KDM4EL3MBTL1MEN1KMT2APOLB
SCHEMBL30029167 0.74 HCAR3 (0.48) APAF1POLBMAPT
SCHEMBL30028421 0.74 HCAR3 (0.48) APAF1POLBMAPT
SCHEMBL29480809 0.74 ADORA2A (0.42) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL30686398 0.69 GLP1R (0.40) KDM4EL3MBTL1MEN1TP53PABPC1
SCHEMBL25405520 0.68 GLP1R (0.41) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL29924416 0.68 MEN1 (0.33) MEN1TP53PABPC1KMT2AMGAM
SCHEMBL29556035 0.68 MEN1 (0.41) KDM4EMEN1TP53PABPC1KMT2A
SCHEMBL25405514 0.68 GLP1R (0.41) KDM4EMAPTALDH1A1HPGDHSD17B10
SCHEMBL29392201 0.68 GLP1R (0.41) KDM4EMAPTALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4204415-A1 HETEROCYCLIC GLP-1 AGONISTS Gasherbrum Bio, Inc. (US) 2023-07-05 EP disclosed
WO-2022042691-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2022-03-03 WO disclosed