SCHEMBL6093763

SCHEMBL6093763

Cc1ccc(C(C)NC(=O)c2nc(N3CCCCS3(O)O)n(C)c(=O)c2O)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 2/20 0.36
MAPT P10636 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
PHGDH O43175 3/20 0.36
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
THRB P10828 1/20 0.34
MAOA P21397 1/20 0.34
PDE2A O00408 2/20 0.33
GPR139 Q6DWJ6 2/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL6095582 0.92 MAOA (0.43) ALDH1A1POLBHTTPHGDHMAOA
SCHEMBL6095162 0.92 SMN1; SMN2 (0.38) L3MBTL1TP53MAPTALDH1A1POLB
SCHEMBL6094125 0.92 ALDH1A1 (0.40) L3MBTL1ALDH1A1POLBHTTPHGDH
SCHEMBL6095839 0.91 ALDH1A1 (0.45) L3MBTL1TP53MAPTALDH1A1POLB
SCHEMBL6095305 0.91 ALDH1A1 (0.45) L3MBTL1TP53MAPTALDH1A1POLB
SCHEMBL6093749 0.91 PHGDH (0.43) L3MBTL1TP53MAPTALDH1A1POLB
SCHEMBL6094437 0.90 CLK1 (0.39) TP53MAPTPHGDHTDP1PDE2A
SCHEMBL6094063 0.87 MEN1 (0.42) L3MBTL1ALDH1A1POLBHTTPHGDH
SCHEMBL6096240 0.83 POLB (0.42) MAPTPOLB
SCHEMBL6096426 0.83 CALCA (0.45) L3MBTL1TP53MAPTPOLB

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-7135467-B2 Pyrimidine carboxamides; 5-hydroxy-2-(2-(1,1-Dioxo-6-[1,2]thiazinan-2-yl)-6-oxo-1,6-dihydropyrimidine-4-carboxamides; AIDS; AIDS related complex BRISTOL-MYERS SQUIBB COMPANY (US) 2006-11-14 US claimed
US-20040204498-A1 HIV integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-10-14 US claimed
US-7135467-B2 Pyrimidine carboxamides; 5-hydroxy-2-(2-(1,1-Dioxo-6-[1,2]thiazinan-2-yl)-6-oxo-1,6-dihydropyrimidine-4-carboxamides; AIDS; AIDS related complex BRISTOL-MYERS SQUIBB COMPANY (US) 2006-11-14 US disclosed
US-20040204498-A1 HIV integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-10-14 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-20040204498-A1 HIV integrase inhibitors IMPDH1, TYMP, REV1 L3MBTL1 189/4885TP53 2504/4885MAPT 3749/4885

“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.