SCHEMBL5507449

SCHEMBL5507449

C[CH]OC(=O)OCCCCCCCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
HCAR2 Q8TDS4 2/20 0.50
EPHX1 P07099 1/20 0.50
TSHR P16473 3/20 0.48
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATM Q13315 1/20 0.45
FAAH O00519 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 6/20 0.44
DGKA P23743 1/20 0.44

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
SCHEMBL5512249 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL5512033 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL5514096 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL5506856 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL5517476 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL5510321 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL450585 1.00 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL450736 0.98 NAAA (0.50) NAAAHCAR2EPHX1TSHRRAD52
SCHEMBL444270 0.92 ATM (0.54) NAAAHCAR2EPHX1TSHRNPSR1
SCHEMBL27841060 0.84 NAAA (0.53) NAAAHCAR2EPHX1TSHRRAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7157442-B2 Antibacterial compound SANKYO COMPANY, LIMITED (JP) 2007-01-02 US disclosed
EP-1209166-B1 NOVEL A-500359 DERIVATIVES SANKYO CO (JP) 2004-03-31 EP disclosed
US-20030171330-A1 Antibacterial compound SANKYO COMPANY, LIMITED (JP) 2003-09-11 US disclosed
EP-1209166-A1 NOVEL A-500359 DERIVATIVES Sankyo Company, Limited (JP) 2002-05-29 EP 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-20030171330-A1 Antibacterial compound TLR1, MPO, O60361 NAAA 1397/4885HCAR2 2946/4885EPHX1 3783/4885

“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.