SCHEMBL28543738

SCHEMBL28543738

CC(=O)ON1CCC(c2cccnc2OCc2ccc(Cl)cc2F)CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.43
HTR6 P50406 1/20 0.41
GLP1R P43220 9/20 0.40
HTR1A P08908 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL28545272 0.87 KCNH2 (0.41) P2RX7HTR6GLP1R
Ammonia Solution, Strong SCHEMBL28911105 0.86 KCNH2 (0.41) P2RX7HTR6GLP1R
SCHEMBL23235671 0.86 P2RX7 (0.45) P2RX7GLP1R
SCHEMBL30676121 0.84 GLP1R (0.44) P2RX7GLP1R
SCHEMBL23235675 0.84 GLP1R (0.44) P2RX7GLP1R
SCHEMBL25088373 0.84 KCNH2 (0.45) P2RX7HTR6GLP1RHTR1ASLC6A2
SCHEMBL28540333 0.83 MEN1 (0.42)
SCHEMBL23928943 0.83 FNTA (0.48)
SCHEMBL30714805 0.82 GLP1R (0.42) P2RX7GLP1R
SCHEMBL31009241 0.79 SLC6A2 (0.59) HTR6HTR1ASLC6A2SLC6A4

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-112566637-B GLP-1 receptor agonists and uses thereof 辉瑞公司 2023-11-14 CN disclosed
CN-112566637-A GLP-1 receptor agonists and uses thereof 辉瑞公司 2021-03-26 CN disclosed