SCHEMBL6094150

SCHEMBL6094150

CCOC(=O)c1nc(N2CCN(S(C)(=O)=O)CC2)n(C)c(=O)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
TRPV4 Q9HBA0 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 3/20 0.37
LMNA P02545 2/20 0.37
MAPK1 P28482 2/20 0.37
HTT P42858 3/20 0.37
KMT2A Q03164 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALDH1A1 P00352 2/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OGFRL1 Q5TC84 1/20 0.34
GAA P10253 2/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 2/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
XBP1 P17861 1/20 0.34

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
SCHEMBL6094714 0.83 MAPT (0.40) MAPTTRPV4L3MBTL1POLBLMNA
SCHEMBL6093597 0.82 HTT (0.52) L3MBTL1POLBLMNAMAPK1HTT
SCHEMBL6087140 0.81 MAPK1 (0.40) MAPTTRPV4L3MBTL1POLBLMNA
SCHEMBL6094824 0.79 DCTPP1 (0.41) L3MBTL1LMNAHTTALDH1A1GAA
SCHEMBL6087943 0.78 LMNA (0.36) MAPTTRPV4L3MBTL1POLBLMNA
SCHEMBL6086735 0.76 MAPK1 (0.36) MAPTTRPV4L3MBTL1POLBLMNA
SCHEMBL6093771 0.76 LMNA (0.35) TRPV4L3MBTL1POLBLMNAMAPK1
SCHEMBL6087228 0.76 CYP11B1 (0.39) TRPV4POLBLMNAMAPK1HTT
SCHEMBL6087462 0.75 HTT (0.37) TRPV4L3MBTL1POLBLMNAMAPK1
SCHEMBL6086716 0.73 LMNA (0.33) TRPV4POLBLMNAMAPK1HTT

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 2 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 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 MAPT 3749/4885TRPV4 4850/4885L3MBTL1 189/4885

“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.