SCHEMBL9955274

SCHEMBL9955274

O=C(O)CCC(NC(=O)CCC(NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.60
MME P08473 1/20 0.56
ECE1 P42892 1/20 0.56
NAALAD2 Q9Y3Q0 1/20 0.52
PPARA Q07869 2/20 0.50
PPARG P37231 1/20 0.50
SIRT2 Q8IXJ6 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA9 Q16790 1/20 0.48

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
SCHEMBL9955269 1.00 FOLH1 (0.60) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL9697060 0.96 FOLH1 (0.64) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL19307785 0.96 FOLH1 (0.64) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL19925534 0.96 FOLH1 (0.64) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL9698236 0.96 FOLH1 (0.64) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL24238520 0.96 FOLH1 (0.64) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL2921260 0.91 FOLH1 (0.59) FOLH1MMEECE1
SCHEMBL910423 0.91 FOLH1 (0.70) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL910233 0.91 FOLH1 (0.70) FOLH1MMEECE1NAALAD2PPARA
SCHEMBL7624700 0.91 FOLH1 (0.59) FOLH1MMEECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458188-B2 Efficient peptide couplings and their use in the synthesis and isolation of a cyclopenta (G) quinazoline trisodium salt BTG INTERNATIONAL LIMITED (GB) 2016-10-04 US claimed
US-20130345423-A1 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT Onyx Pharmaceutical, Inc. (US) 2013-12-26 US claimed
EP-2655398-A2 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT Onyx Pharmaceuticals, Inc. (US) 2013-10-30 EP claimed
WO-2012087888-A2 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT ONYX PHARMACEUTICALS, INC. (US) 2012-06-28 WO claimed
US-9458188-B2 Efficient peptide couplings and their use in the synthesis and isolation of a cyclopenta (G) quinazoline trisodium salt BTG INTERNATIONAL LIMITED (GB) 2016-10-04 US disclosed
EP-2655398-B1 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT BTG INT LTD (GB) 2016-08-24 EP disclosed
US-20130345423-A1 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT Onyx Pharmaceutical, Inc. (US) 2013-12-26 US disclosed
EP-2655398-A2 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT Onyx Pharmaceuticals, Inc. (US) 2013-10-30 EP disclosed
WO-2012087888-A2 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT ONYX PHARMACEUTICALS, INC. (US) 2012-06-28 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-20130345423-A1 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT GLUL, QPCT, GLS FOLH1 94/4885MME 1290/4885ECE1 1983/4885

“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.