SCHEMBL5559741

SCHEMBL5559741

COc1cnc(N2CCOCC2)cc1NC(=O)N(S)C(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ ALDH1A1 P00352 5/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ MTOR P42345 4/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ TRPM8 Q7Z2W7 1/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ AKT1 P31749 1/20 0.41
▸ WNT3A P56704 4/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL3053533 0.83 MAPT (0.52) MAPTSMN1; SMN2ALOX15ALDH1A1NPC1
SCHEMBL5559730 0.80 GAA (0.59) MAPTSMN1; SMN2ALOX15ALDH1A1NPC1
SCHEMBL5558780 0.73 CYP2C19 (0.45) SMN1; SMN2ALDH1A1MTORCYP2C19AKT1
SCHEMBL6875469 0.72 SMN1; SMN2 (0.40) MAPTSMN1; SMN2ALOX15ALDH1A1NPC1
SCHEMBL5558787 0.71 CYP2C19 (0.43) MAPTALDH1A1MTORCYP1A2CYP2C19
SCHEMBL5563645 0.70 MAPT (0.35) MAPTSMN1; SMN2ALOX15NPC1MTOR
SCHEMBL6878390 0.70 MAPT (0.40) MAPTSMN1; SMN2ALOX15ALDH1A1NPC1
SCHEMBL11065200 0.68 OPRM1 (0.37) MAPTALOX15ALDH1A1CYP1A2CYP3A4
SCHEMBL30989601 0.68 KMO (0.51) MAPTALDH1A1MTORCYP1A2CYP2C19
SCHEMBL6878049 0.66 ALDH1A1 (0.41) MAPTSMN1; SMN2ALDH1A1LMNAWNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273865-B2 Thiazolopyridine HOFFMANN-LA ROCHE INC. (US) 2007-09-25 — — US disclosed
EP-1670805-A1 THIAZOLOPYRIDINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2006-06-21 — — EP disclosed
WO-2005028484-A1 THIAZOLOPYRIDINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2005-03-31 — — WO disclosed
US-20050065151-A1 Thiazolopyridine HOFFMANN-LA ROCHE INC. 2005-03-24 — — US 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-20050065151-A1 Thiazolopyridine ADORA2A, ADORA3, ADORA1 MAPT 644/4885SMN1; SMN2 1416/4885ALOX15 2250/4885

“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.

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