SCHEMBL4969361

SCHEMBL4969361

CCCCCCCC(CC(=O)O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.50
MMP1 P03956 4/20 0.50
MMP3 P08254 4/20 0.50
CETP P11597 3/20 0.50
CNR2 P34972 1/20 0.46
MMP9 P14780 1/20 0.45
MMP12 P39900 1/20 0.45
GPR84 Q9NQS5 1/20 0.45

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
SCHEMBL1359365 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
SCHEMBL1358861 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
SCHEMBL29893945 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
SCHEMBL1359364 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
SCHEMBL1358863 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
SCHEMBL1358859 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
SCHEMBL1358862 1.00 MMP2 (0.50) MMP2MMP1MMP3CETPCNR2
Hydrochloric Acid SCHEMBL2679110 0.99 MMP2 (0.49) MMP2MMP1MMP3CETP
Hydrochloric Acid SCHEMBL2679113 0.99 MMP2 (0.49) MMP2MMP1MMP3CETP
SCHEMBL30873579 0.99 MMP2 (0.48) MMP2MMP1MMP3CETPCNR2

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
EP-1460994-B1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES FIRMENICH & CIE (CH) 2008-10-01 EP claimed
US-20230227489-A1 GLYCOLIPOPEPTIDE BIOSURFACTANTS CRODA INTERNATIONAL PLC (GB) 2023-07-20 US disclosed
EP-3440179-A2 GLYCOLIPOPEPTIDE BIOSURFACTANTS Croda International PLC (GB) 2019-02-13 EP disclosed
WO-2017174748-A2 GLYCOLIPOPEPTIDE BIOSURFACTANTS CRODA INTERNATIONAL PLC (GB) 2017-10-12 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-20230227489-A1 GLYCOLIPOPEPTIDE BIOSURFACTANTS LYPLAL1, LNPEP, PHOSPHO1 MMP2 1888/4885MMP1 2947/4885MMP3 1625/4885

“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.