SCHEMBL12648688

SCHEMBL12648688

CC(=O)NCC(=O)N[C@H](CCC(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 8/20 0.59
▸ NAALAD2 Q9Y3Q0 2/20 0.56
▸ RIMKLA Q8IXN7 1/20 0.56
▸ GNPAT O15228 1/20 0.45
▸ GGH Q92820 1/20 0.45
▸ NOD1 Q9Y239 1/20 0.44
▸ FNTA P49354 2/20 0.43
▸ FNTB P49356 2/20 0.43
▸ EPHX2 P34913 1/20 0.43

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
SCHEMBL468801 1.00 FOLH1 (0.59) FOLH1NAALAD2RIMKLAGNPATGGH
SCHEMBL468800 1.00 FOLH1 (0.59) FOLH1NAALAD2RIMKLAGNPATGGH
SCHEMBL19185486 0.87 FOLH1 (0.46) FOLH1NAALAD2RIMKLAGNPATNOD1
SCHEMBL9074250 0.87 FOLH1 (0.46) FOLH1NAALAD2RIMKLAGNPATNOD1
SCHEMBL29822167 0.85 FOLH1 (0.66) FOLH1NAALAD2RIMKLAGNPATNOD1
SCHEMBL24302141 0.83 FOLH1 (0.43) FOLH1NAALAD2RIMKLAGNPATNOD1
SCHEMBL18272425 0.82 FOLH1 (0.60) FOLH1NAALAD2RIMKLAGNPATGGH
SCHEMBL15958206 0.82 FOLH1 (0.60) FOLH1NAALAD2RIMKLAGNPATGGH
SCHEMBL18082026 0.82 FOLH1 (0.60) FOLH1NAALAD2RIMKLAGNPATGGH
SCHEMBL19718595 0.82 FOLH1 (0.60) FOLH1NAALAD2RIMKLAGNPATGGH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220244263-A1 METHODS FOR TREATING SMALL CELL NEUROENDOCRINE AND RELATED CANCERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-08-04 — — US disclosed
US-9034798-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2015-05-19 — — US disclosed
US-8569481-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions PHARMACEUTICALS, INC. (US) 2013-10-29 — — US disclosed
EP-2259068-B1 Capture compounds and methods for analyzing the proteome CAPROTEC BIOANALYTICS GMBH (DE) 2013-08-14 — — EP disclosed
US-20110118136-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions KOESTER HUBERT 2011-05-19 — — US disclosed
US-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-11-25 — — US disclosed
US-20100248264-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-09-30 — — US 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 (2 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-20110118136-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions PTMS, QPCTL, SRMS FOLH1 3454/4885NAALAD2 289/4885RIMKLA 2585/4885
US-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CHLSN, PTMS, SRMS FOLH1 2698/4885NAALAD2 927/4885RIMKLA 2575/4885

“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.

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