SCHEMBL1659486

SCHEMBL1659486

CCC(C)C([C]=O)NCC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.37
ACE P12821 2/20 0.37
CPA1 P15085 2/20 0.37
ACE2 Q9BYF1 2/20 0.37
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
ALDH1A1 P00352 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL1659488 1.00 MME (0.37) MMEACECPA1ACE2MMP1
SCHEMBL4957734 0.76 ALDH1A1 (0.36) MMEACECPA1ACE2MMP1
SCHEMBL1657594 0.76 ALDH1A1 (0.36) MMEACECPA1ACE2MMP1
SCHEMBL1657591 0.76 ALDH1A1 (0.36) MMEACECPA1ACE2MMP1
SCHEMBL22306273 0.75 MME (0.37) MMEACECPA1ACE2ALDH1A1
SCHEMBL7081089 0.74
SCHEMBL26292989 0.74
SCHEMBL26292991 0.74
SCHEMBL20444166 0.72 MME (0.35) MMEACECPA1ACE2ALDH1A1
SCHEMBL597622 0.72 ALDH1A1 (0.53) MMEACECPA1ACE2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110297820-A1 PSEUDACYCLIN AND METHOD OF INDICATION OF A FUNGUS PSEUDALLESCHERIA BOYDII INSTITUTE OF MICROBIOLOGY AS CR, V.V.I. (CZ) 2011-12-08 US disclosed
EP-2303915-A2 PSEUDACYCLIN AND METHOD OF INDICATION OF A FUNGUS PSEUDALLESCHERIA BOYDII Institute Of Microbiology AS CR, v.v.i. (CZ) 2011-04-06 EP disclosed
WO-2009149675-A2 PSEUDACYCLIN AND METHOD OF INDICATION OF A FUNGUS PSEUDALLESCHERIA BOYDII INSTITUTE OF MICROBIOLOGY AS CR, V.V.I. (CZ) 2009-12-17 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-20110297820-A1 PSEUDACYCLIN AND METHOD OF INDICATION OF A FUNGUS PSEUDALLESCHERIA BOYDII PPIA, PPIG, PPID MME 2184/4885ACE 2399/4885CPA1 97/4885

“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.