SCHEMBL5840486

SCHEMBL5840486

NCCCC[C@H](NOCc1ccccc1C(=O)O)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
FOLH1 Q04609 3/20 0.41
TP53 P04637 1/20 0.39
HTT P42858 1/20 0.39
TLR2 O60603 2/20 0.39
ITGB3 P05106 6/20 0.39
ITGA2B P08514 6/20 0.39
ANPEP P15144 1/20 0.39
CPB2 Q96IY4 2/20 0.38
ECE1 P42892 1/20 0.38
CPB1 P15086 1/20 0.38
ACE P12821 1/20 0.38

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
SCHEMBL6152838 1.00 MMP2 (0.45) MMP2MMP9FOLH1TP53HTT
SCHEMBL8664220 1.00 MMP2 (0.45) MMP2MMP9FOLH1TP53HTT
SCHEMBL7226853 0.83 MMP2 (0.50) MMP2MMP9TLR2ITGB3ITGA2B
SCHEMBL7226850 0.83 MMP2 (0.50) MMP2MMP9TLR2ITGB3ITGA2B
Methane SCHEMBL28261132 0.82 MMP2 (0.49) MMP2MMP9TLR2ITGB3ITGA2B
SCHEMBL8645817 0.80 MMP2 (0.47) MMP2MMP9FOLH1TLR2ANPEP
SCHEMBL3982664 0.79 NPC1 (0.46) MMP2MMP9TLR2ITGB3ITGA2B
SCHEMBL11023403 0.76 MME (0.46) FOLH1ACE
SCHEMBL2184040 0.76 TLR2 (0.47) MMP2MMP9FOLH1TLR2
SCHEMBL29087594 0.72 TLR2 (0.44) MMP2MMP9TP53TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7135502-B1 Colchinol derivatives as vascular damaging agents ANGIOGENE PHARMACEUTICALS LTD. (GB) 2006-11-14 US disclosed
US-20060128633-A1 Colchinol derivatives as vascular damaging agents ANGIOGENE PHARMACEUTICALS LTD. 2006-06-15 US disclosed
EP-1140745-B1 COLCHINOL DERIVATIVES AS VASCULAR DAMAGING AGENTS ANGIOGENE PHARM LTD (GB) 2003-10-22 EP disclosed
EP-1140745-A1 COLCHINOL DERIVATIVES AS VASCULAR DAMAGING AGENTS Angiogene Pharmaceuticals Ltd (GB) 2001-10-10 EP disclosed
WO-2000040529-A1 COLCHINOL DERIVATIVES AS VASCULAR DAMAGING AGENTS ANGIOGENE PHARMACEUTICALS LTD. (GB) 2000-07-13 WO 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-20060128633-A1 Colchinol derivatives as vascular damaging agents NR1H3, NR1H2, NR1H4 MMP2 4497/4885MMP9 3467/4885FOLH1 1676/4885

“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.