SCHEMBL318740

SCHEMBL318740

CCN1CCCC(NC(=O)O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
INMT O95050 1/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
ACE P12821 5/20 0.41
MME P08473 1/20 0.40
F10 P00742 2/20 0.39
APP P05067 1/20 0.38
MMP1 P03956 7/20 0.38
MMP3 P08254 7/20 0.38
NPY1R P25929 1/20 0.38
SRC P12931 1/20 0.37

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
SCHEMBL318738 1.00 INMT (0.42) INMTGAAL3MBTL1ACEMME
SCHEMBL21143944 0.95 ACE (0.44) GAAL3MBTL1ACEMMEF10
SCHEMBL5638958 0.95 ACE (0.44) GAAL3MBTL1ACEMMEF10
SCHEMBL13464988 0.84 MMP1 (0.43) INMTGAAL3MBTL1ACEMME
SCHEMBL318215 0.81 MMP1 (0.53) ACEMMEMMP1MMP3SRC
SCHEMBL319693 0.80 F2 (0.56) GAAL3MBTL1F10MMP1MMP3
SCHEMBL319691 0.80 F2 (0.56) GAAL3MBTL1F10MMP1MMP3
SCHEMBL10560930 0.80 GAA (0.36) INMTGAAL3MBTL1ACE
SCHEMBL10560918 0.80 GAA (0.36) INMTGAAL3MBTL1ACE
SCHEMBL10941726 0.79 ACE (0.59) ACEMMEF10MMP1MMP3

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-20130190289-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-25 US disclosed
EP-2585447-A2 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS Vertex Pharmaceuticals Incorporated (US) 2013-05-01 EP disclosed
WO-2012006055-A2 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-01-12 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-20130190289-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS SLC10A1, ACE, CEL INMT 1469/4885GAA 64/4885L3MBTL1 3591/4885

“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.