SCHEMBL6094467

SCHEMBL6094467

CCCNCCCCNCCCCNCCCCN(O)C(C(S(=O)(=O)c1c(C)cc(C)cc1C)S(=O)(=O)c1c(C)cc(C)cc1C)(S(=O)(=O)c1c(C)cc(C)cc1C)S(=O)(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
NR3C1 P04150 3/20 0.32
PGR P06401 3/20 0.32
NR3C2 P08235 3/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
ALOX12 P18054 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL6413864 0.71 CA1 (0.39) FABP4CA1CA2MMP1MMP2
SCHEMBL5887533 0.70 CA1 (0.42) FABP4CA1CA2MMP1MMP2
SCHEMBL5887535 0.65 MAPT (0.46) FABP4CA1CA2MMP1MMP2
SCHEMBL7937672 0.60 FABP4 (0.36) FABP4CA1CA2MMP1MMP2
SCHEMBL4746886 0.60 NR3C1 (0.36) FABP4CA1CA2MMP1MMP2
SCHEMBL6414538 0.60 FABP4 (0.51) FABP4CA1CA2MMP1MMP2
SCHEMBL7513482 0.59 CA12 (0.41) FABP4CA1CA2MMP1MMP2
SCHEMBL14080720 0.58 CNR2 (0.41) CA1CA2MMP1MMP2MMP9
SCHEMBL3687291 0.58 L3MBTL1 (0.61) FABP4CA1CA2MMP1MMP2
SCHEMBL7930818 0.57 CA1 (0.58) FABP4CA1CA2MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060276444-A1 Porphyrin-polyamine conjugates for cancer therapy PROGEN PHARMACEUTICALS, INC. 2006-12-07 US disclosed
US-7026347-B2 Porphyrin-polyamine conjugates for cancer therapy CELLGATE, INC. (US) 2006-04-11 US disclosed
US-20040152687-A1 Porphyrin-polyamine conjugates for cancer therapy CELLGATE, INC. 2004-08-05 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 (2 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-20060276444-A1 Porphyrin-polyamine conjugates for cancer therapy SRM, PAICS, FOLH1 FABP4 4568/4885CA1 3732/4885CA2 4274/4885
US-20040152687-A1 Porphyrin-polyamine conjugates for cancer therapy SRM, PAICS, FOLH1 FABP4 4568/4885CA1 3732/4885CA2 4274/4885

“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.