SCHEMBL6095170

SCHEMBL6095170

Cn1c(N2CCCCS2(O)O)nc(C(=O)NCc2ccc(Cl)cc2)c(O)c1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CALCA P06881 7/20 0.44
TP53 P04637 3/20 0.44
LMNA P02545 2/20 0.44
THRB P10828 2/20 0.42
MAPT P10636 2/20 0.41
KCNE1 P15382 1/20 0.40
CCR1 P32246 1/20 0.40
KCNQ1 P51787 1/20 0.40
CYP2C9 P11712 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
SCHEMBL6096426 0.92 CALCA (0.45) MEN1KMT2ACALCATP53LMNA
SCHEMBL6093767 0.91 LIPG (0.43) MEN1KMT2ATP53LMNATHRB
SCHEMBL6095158 0.91 CALCA (0.52) MEN1KMT2ACALCATP53LMNA
SCHEMBL6095269 0.91 CALCA (0.54) MEN1KMT2ACALCAKCNE1CCR1
SCHEMBL6095009 0.91 CALCA (0.43) MEN1KMT2ACALCATP53LMNA
SCHEMBL6093561 0.91 CALCA (0.54) MEN1KMT2ACALCATP53THRB
SCHEMBL6094168 0.90 CALCA (0.44) CALCA
SCHEMBL6094901 0.90 CALCA (0.46) MEN1KMT2ACALCAKCNE1CCR1
SCHEMBL6094025 0.89 CALCA (0.49) MEN1KMT2ACALCATP53LMNA
SCHEMBL6097061 0.89 MAPT (0.44) CALCATP53LMNATHRBMAPT

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 MEN1 4267/4885KMT2A 1080/4885CALCA 4716/4885

“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.