SCHEMBL6442540

SCHEMBL6442540

S=Cc1ccc(Cc2cc(Br)ccc2Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 13/20 0.38
SLC5A1 P13866 12/20 0.38
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
KCNH2 Q12809 1/20 0.34
CCR5 P51681 3/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
GPR183 P32249 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
SCHEMBL500019 0.85 ALDH1A1 (0.44) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL499800 0.84 SLC5A2 (0.48) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL12782162 0.81 CCR5 (0.47) HTR2ASLC6A4KCNH2CCR5MEN1
SCHEMBL5681425 0.81 SLC5A2 (0.33) SLC5A2SLC5A1CCR5
SCHEMBL500031 0.80 SLC6A4 (0.37) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL37715 0.78 SLC5A2 (0.47) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL499287 0.78 SLC5A2 (0.38) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL1457579 0.78 APP (0.40) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL17842 0.78 MEN1 (0.46) SLC5A2SLC5A1HTR2ASLC6A4KCNH2
SCHEMBL29816996 0.78 MEN1 (0.46) SLC5A2SLC5A1HTR2ASLC6A4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936590-B2 C-aryl glucoside SGLT2 inhibitors and method BRISTOL MYERS SQUIBB COMPANY (US) 2005-08-30 US disclosed
EP-1224195-B1 C-ARYL GLUCOSIDE SGLT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2005-05-18 EP disclosed
US-20030114390-A1 C-aryl glucoside SGLT2 inhibitors and method ASTRAZENECA AB (SE) 2003-06-19 US disclosed
EP-1224195-A1 C-ARYL GLUCOSIDE SGLT2 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-07-24 EP disclosed
US-6414126-B1 ANTIDIABETIC, ANTIOBESITY, ANTILIPEMIC, ANTIATHEROSCLEROTIC, ANTICOAGULANT, AND HYPOTENSIVE AGENTS; MARKUSH ENCOMPASSING DAPAGLIFOZIN AND DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY 2002-07-02 US disclosed
WO-2001027128-A1 C-ARYL GLUCOSIDE SGLT2 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-04-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030114390-A1 C-aryl glucoside SGLT2 inhibitors and method SLC5A2, SLC5A1, UGGT1 SLC5A2 1/4885SLC5A1 2/4885HTR2A 1688/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.