SCHEMBL28680852

SCHEMBL28680852

CC(OS(C)(=O)=O)c1ccc(Cl)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
CYP3A5 P20815 1/20 0.41
PSEN1 P49768 5/20 0.40
PSEN2 P49810 5/20 0.40
APH1B Q8WW43 5/20 0.40
NCSTN Q92542 5/20 0.40
APH1A Q96BI3 5/20 0.40
PSENEN Q9NZ42 5/20 0.40
CCR2 P41597 1/20 0.39
OPRM1 P35372 3/20 0.39
FPR2 P25090 1/20 0.36
PROKR1 Q8TCW9 1/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
CXCR3 P49682 1/20 0.36
MDM2 Q00987 1/20 0.35

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
SCHEMBL20303483 0.89 PSEN1 (0.44) CYP3A4CYP3A5PSEN1PSEN2APH1B
SCHEMBL15054088 0.80 TP53 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20303378 0.78 CNR2 (0.40) HTT
SCHEMBL32682742 0.78 CNR2 (0.40) HTT
SCHEMBL29109558 0.78 ALDH1A1 (0.38) ALDH1A1
SCHEMBL15853893 0.78 LMNA (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL32682750 0.77 HTT (0.37) CCR2FPR2PROKR1ALDH1A1HTT
SCHEMBL20241435 0.77 HTT (0.37) CCR2FPR2PROKR1ALDH1A1HTT
SCHEMBL21261357 0.77 MC4R (0.44) ALDH1A1LMNATP53HTTKMT2A
SCHEMBL17226297 0.76 LMNA (0.40) CYP3A4CYP3A5PSEN1PSEN2APH1B

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-113227068-B GLP-1R agonists and uses thereof 上海齐鲁锐格医药研发有限公司 2023-06-13 CN disclosed
CN-113227068-A GLP-1R agonists and uses thereof 上海齐鲁锐格医药研发有限公司 2021-08-06 CN disclosed