SCHEMBL25269986

SCHEMBL25269986

Cn1c(C(=O)O)cnc1CCl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
ALOX15 P16050 2/20 0.40
LMNA P02545 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HRH3 Q9Y5N1 1/20 0.36
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
MCL1 Q07820 2/20 0.33
KDM4E B2RXH2 2/20 0.33
GPR35 Q9HC97 1/20 0.33
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
HSD17B10 Q99714 3/20 0.32
MAPK1 P28482 1/20 0.32
GFER P55789 1/20 0.31
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL14038235 0.83 ALOX15 (0.55) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL25269324 0.83 ALDH1A1 (0.41) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL2825471 0.81 RAB9A (0.50) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL8654020 0.80 ALOX15 (0.57) ALDH1A1ALOX15LMNANPSR1L3MBTL1
Hydrochloric Acid SCHEMBL2825470 0.80 RAB9A (0.49) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL2825362 0.79 ALDH1A1 (0.44) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL2823116 0.79 ALDH1A1 (0.38) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL14012153 0.79 LMNA (0.38) ALDH1A1ALOX15LMNANPSR1L3MBTL1
SCHEMBL2825371 0.75 HRH3 (0.45) ALDH1A1L3MBTL1HRH3KDM4EMAPK1
SCHEMBL3400738 0.75 MEN1 (0.43) ALDH1A1ALOX15L3MBTL1MEN1KMT2A

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
CN-116323599-A Heterocyclic GLP-1 agonists 加舒布鲁姆生物公司 2023-06-23 CN disclosed
EP-4192831-A1 HETEROCYCLIC GLP-1 AGONISTS Gasherbrum Bio, Inc. (US) 2023-06-14 EP disclosed