SCHEMBL5840295

SCHEMBL5840295

NCC(=O)NCCC([O])=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
ECE1 P42892 1/20 0.37
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MMP2 P08253 1/20 0.32
CASP2 P42575 1/20 0.31
AOC3 Q16853 2/20 0.31
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30
TSHR P16473 1/20 0.30
CACNA1G O43497 1/20 0.30

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
SCHEMBL3074874 0.81 CA2 (0.44) CA2CA1ALDH1A1MEN1KMT2A
SCHEMBL385127 0.80 ECE1 (0.58) ECE1KMT2AGLRA1SLC6A9OR51E2
SCHEMBL2200631 0.80 CA2 (0.38) CA2CA1ECE1ALDH1A1MEN1
SCHEMBL28969880 0.77 CA1 (0.39) CA2CA1ECE1ALDH1A1MEN1
SCHEMBL16853212 0.76 ALDH1A1 (0.55) CA2CA1ALDH1A1MEN1KMT2A
SCHEMBL152135 0.76
SCHEMBL12660515 0.76 MEN1 (0.48) CA2CA1ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL25330006 0.75 CA1 (0.38) CA2CA1ECE1ALDH1A1MEN1
SCHEMBL18404145 0.75 LMNA (0.52) CA2ALDH1A1MEN1KMT2ATSHR
Oxalic Acid SCHEMBL28780170 0.75 ECE1 (0.52) CA2CA1ECE1KMT2AGLRA1

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 CA2 2559/4885CA1 1906/4885ECE1 1305/4885

“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.