SCHEMBL11367249

SCHEMBL11367249

COCCOCCN(CCC(C)=O)CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.38
SLC15A2 Q16348 1/20 0.38
KDM4E B2RXH2 2/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
TSHR P16473 1/20 0.32
CA1 P00915 9/20 0.32
CA2 P00918 9/20 0.32
KDM5A P29375 1/20 0.31

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
SCHEMBL11367273 0.93 BLM (0.53) BLMPMP22HSD17B10ALDH1A1KDM4E
SCHEMBL11370676 0.89 TSHR (0.39) BLMPMP22HSD17B10ALDH1A1LMNA
Malonic Acid SCHEMBL3706228 0.84 BLM (0.55) BLMPMP22HSD17B10ALDH1A1KDM4E
SCHEMBL5067890 0.82 ALDH1A1 (0.50) BLMPMP22HSD17B10ALDH1A1LMNA
SCHEMBL11367338 0.81 TSHR (0.42) BLMPMP22HSD17B10ALDH1A1LMNA
SCHEMBL6322193 0.79 BLM (0.44) BLMPMP22HSD17B10ALDH1A1KDM6B
Hexanoate SCHEMBL28978866 0.79 AKR1B1 (0.52) BLMPMP22HSD17B10ALDH1A1PHF8
Octanoic Acid SCHEMBL28979171 0.78 GPR84 (0.53) BLMHSD17B10ALDH1A1LMNAPHF8
Dodecanoate SCHEMBL28979170 0.78 GPR84 (0.53) BLMHSD17B10ALDH1A1LMNAPHF8
SCHEMBL23173755 0.77 KMT2A (0.42) BLMPMP22HSD17B10ALDH1A1LMNA

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-8222449-B2 Metal oxide-chelating ligands THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2012-07-17 US disclosed
US-20110137079-A1 METAL OXIDE-CHELATING LIGANDS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2011-06-09 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 (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-20110137079-A1 METAL OXIDE-CHELATING LIGANDS SOD1, SLC39A11, AP2S1 BLM 2832/4885PMP22 3451/4885HSD17B10 4761/4885

“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.