SCHEMBL25757049

SCHEMBL25757049

Cc1cccc(C2CC(O)C(C(O)CO)O2)c1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 8/20 0.37
HTR2C P28335 3/20 0.37
HTR2A P28223 1/20 0.37
SLC6A4 P31645 1/20 0.37
HTR2B P41595 1/20 0.37
SLC6A3 Q01959 1/20 0.37
EPHX1 P07099 1/20 0.34
SLC5A1 P13866 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
ALOX15B O15296 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 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
SCHEMBL14605468 0.78 SLC5A2 (0.49) SLC5A2HTR2CHTR2ASLC6A4HTR2B
SCHEMBL13969632 0.78 SLC5A2 (0.49) SLC5A2HTR2CHTR2ASLC6A4HTR2B
SCHEMBL26764732 0.77 SLC5A2 (0.57) SLC5A2SLC5A1
SCHEMBL21600643 0.72 HTR2C (0.49) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL25757174 0.71 SLC5A2 (0.42) SLC5A2HTR2CHTR2ASLC6A4HTR2B
SCHEMBL22200140 0.71 SLC5A2 (0.43) SLC5A2HTR2CHTR2AHTR2BSLC5A1
SCHEMBL1964991 0.69 MEN1 (0.38) SLC5A2HTR2CHTR2ASLC6A4HTR2B
SCHEMBL13885909 0.64 MANBA (0.37)
SCHEMBL1499496 0.64 TSHR (0.54) HTR2CHTR2ASLC6A4HTR2BSLC6A3
SCHEMBL7779276 0.64 TSHR (0.54) HTR2CHTR2ASLC6A4HTR2BSLC6A3

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-4206212-A1 SGLT-2 INHIBITOR SARCOSINE CO-CRYSTAL, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Creatron Institute of Pharmaceutical Research Co., Ltd. (CN) 2023-07-05 EP disclosed