SCHEMBL4556926

SCHEMBL4556926

CN(C(=O)OCc1ccc(NC(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)c1ccc(N(CCO)CCO)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 15/20 0.50
NAALAD2 Q9Y3Q0 1/20 0.42
CCKBR P32239 2/20 0.41
FPR2 P25090 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
SCHEMBL4473167 0.92 FOLH1 (0.49) FOLH1NAALAD2CCKBRFPR2
SCHEMBL4465270 0.92 FOLH1 (0.49) FOLH1NAALAD2CCKBRFPR2
SCHEMBL4464533 0.92 FOLH1 (0.49) FOLH1NAALAD2CCKBR
SCHEMBL13610863 0.92 FOLH1 (0.49) FOLH1NAALAD2CCKBRFPR2
SCHEMBL14497681 0.92 FOLH1 (0.49) FOLH1NAALAD2CCKBRFPR2
SCHEMBL14497677 0.92 FOLH1 (0.49) FOLH1NAALAD2CCKBR
SCHEMBL13610257 0.89 FOLH1 (0.52) FOLH1NAALAD2CCKBRFPR2
SCHEMBL14497773 0.89 FOLH1 (0.46) FOLH1NAALAD2CCKBRFPR2
SCHEMBL14497770 0.89 FOLH1 (0.46) FOLH1NAALAD2CCKBRFPR2
SCHEMBL14497769 0.89 FOLH1 (0.46) FOLH1NAALAD2CCKBRFPR2

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
EP-1534670-B1 ENZYME ACTIVATED SELF-IMMOLATIVE N-SUBSTITUTED NITROGEN MUSTARD PRODRUGS CANCER REC TECH LTD (GB) 2009-12-02 EP disclosed
US-7235585-B2 Enzyme activated self-immolative n-substituted nitrogen mustard prodrugs CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-06-26 US disclosed
US-20060069154-A1 Enzyme activated self-immolative n-substituted nitrogen mustard prodrugs CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-03-30 US disclosed
EP-1534670-A1 ENZYME ACTIVATED SELF-IMMOLATIVE N-SUBSTITUTED NITROGEN MUSTARD PRODRUGS Cancer Research Technology Limited (GB) 2005-06-01 EP disclosed
WO-2004020400-A1 ENZYME ACTIVATED SELF-IMMOLATIVE N-SUBSTITUTED NITROGEN MUSTARD PRODRUGS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2004-03-11 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-20060069154-A1 Enzyme activated self-immolative n-substituted nitrogen mustard prodrugs CNDP2, PNP, APRT FOLH1 267/4885NAALAD2 83/4885CCKBR 2479/4885

“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.