SCHEMBL6442541

SCHEMBL6442541

O=C(c1ccc(CS)cc1)c1cc(Br)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
MAPT P10636 5/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.42
GAA P10253 1/20 0.41
PTGES O14684 1/20 0.41
IDO1 P14902 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
PTPRC P08575 1/20 0.40
PTPRG P23470 1/20 0.40
PTGDR2 Q9Y5Y4 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
SCHEMBL499583 0.86 ALDH1A1 (0.47) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL48235 0.85 MAPT (0.52) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL5682647 0.82 MAPT (0.50) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL499641 0.81 ALDH1A1 (0.43) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL17755 0.81 ALDH1A1 (0.51) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL30482609 0.81 ALDH1A1 (0.51) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL2637828 0.80 ALDH1A1 (0.50) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL29740498 0.80 ALDH1A1 (0.50) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL1457582 0.80 ALDH1A1 (0.50) ALDH1A1MAPTPOLBHPGDLMNA
SCHEMBL499767 0.80 MAPT (0.67) ALDH1A1MAPTPOLBHPGDLMNA

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 ALDH1A1 641/4885MAPT 1540/4885POLB 4735/4885

“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.