SCHEMBL6334826

SCHEMBL6334826

O=C(O)CSc1ccc(-c2nc(C(=O)O)c(-c3ccccc3)s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.49
▸ L3MBTL1 Q9Y468 4/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ FFAR1 O14842 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ ALOX5 P09917 3/20 0.42
▸ PTGDR2 Q9Y5Y4 2/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GRK6 P43250 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
SCHEMBL6330513 0.87 L3MBTL1 (0.55) MAPTL3MBTL1TDP1ALDH1A1FFAR1
SCHEMBL6329116 0.81 MAPT (0.51) MAPTL3MBTL1TDP1ALDH1A1NPY1R
SCHEMBL6326257 0.81 MAPT (0.51) MAPTL3MBTL1TDP1ALDH1A1NPY1R
SCHEMBL6335374 0.79 STAT3 (0.54) MAPTTDP1ALDH1A1ALOX5PTGDR2
SCHEMBL6325802 0.79 LMNA (0.46) MAPTL3MBTL1TDP1ALDH1A1KDM4E
SCHEMBL6333062 0.78 ALOX5 (0.43) L3MBTL1ALDH1A1ALOX5KDM4E
SCHEMBL7046401 0.75 FFAR1 (0.76) MAPTL3MBTL1ALDH1A1FFAR1APEX1
SCHEMBL5726659 0.75 L3MBTL1 (0.49) MAPTL3MBTL1TDP1ALDH1A1NPY1R
SCHEMBL6370493 0.74 KIF11 (0.49) MAPTALDH1A1ALOX5KDM4E
SCHEMBL28743860 0.71 ALOX5 (0.60) MAPTL3MBTL1ALDH1A1ALOX5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014805-A1 Phenyl substituted 5-membered nitrogen containing heterocycles for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION 2005-01-20 — — 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-20050014805-A1 Phenyl substituted 5-membered nitrogen containing heterocycles for the treatment of obesity GPR119, EGLN3, PC MAPT 3022/4885L3MBTL1 1973/4885TDP1 4209/4885

“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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