SCHEMBL6675478

SCHEMBL6675478

CCCCC(C(=O)N(C)OC)N(C)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.36
CA1 P00915 2/20 0.36
MAPK1 P28482 1/20 0.35
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
SLC1A3 P43003 1/20 0.34
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
PDF Q9HBH1 1/20 0.32
FAAH O00519 1/20 0.32
ZDHHC7 Q9NXF8 1/20 0.31
GPR84 Q9NQS5 3/20 0.31
FFAR1 O14842 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
METAP1 P53582 1/20 0.30
GRIK1 P39086 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
SCHEMBL6675474 1.00 CA2 (0.36) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL6408059 0.81 CA2 (0.36) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL3741553 0.79 FAAH (0.35) FAAH
SCHEMBL6248081 0.79 FAAH (0.35) FAAH
SCHEMBL841620 0.77 EPOR (0.45) FAAHMEN1HPGDKMT2AHSD17B10
SCHEMBL841619 0.77 EPOR (0.45) FAAHMEN1HPGDKMT2AHSD17B10
SCHEMBL27142153 0.76 FAAH (0.40) FAAH
SCHEMBL22342324 0.75 FAAH (0.31) FAAH
SCHEMBL22342320 0.75 FAAH (0.31) FAAH
SCHEMBL18099967 0.75 CA1 (0.42) CA2CA1MAPK1FAAHZDHHC7

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-20040121965-A1 Method of treating resistant tumors WYETH HOLDINGS CORPORATION (US) 2004-06-24 US disclosed
WO-2004026293-A2 HEMIASTERLIN DERIVATIVES FOR TREATING RESISTANT TUMORS WYETH HOLDINGS CORPORATION (US) 2004-04-01 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-20040121965-A1 Method of treating resistant tumors SLC11A2, VHL, REN CA2 32/4885CA1 121/4885MAPK1 3561/4885

“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.