SCHEMBL8065994

SCHEMBL8065994

C[C@@H](C[C@@H](COCO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.80
MMP9 P14780 6/20 0.80
MMP12 P39900 4/20 0.80
ADAM17 P78536 1/20 0.46
MMP1 P03956 3/20 0.44
MMP13 P45452 4/20 0.43
ALDH1A1 P00352 2/20 0.41
UTS2R Q9UKP6 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
MAPK14 Q16539 1/20 0.40
HDAC3 O15379 1/20 0.40

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
SCHEMBL8403058 1.00 MMP2 (0.80) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL5998380 0.89 MMP2 (0.73) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL5998377 0.89 MMP2 (0.73) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL5997913 0.89 MMP2 (1.00) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL5997918 0.89 MMP2 (1.00) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL2378490 0.89 MMP2 (0.72) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL5998355 0.89 MMP2 (0.72) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL5998467 0.89 MMP2 (0.72) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL3043179 0.89 MMP2 (0.72) MMP2MMP9MMP12ADAM17MMP1
SCHEMBL7739858 0.87 MMP2 (0.69) MMP2MMP9MMP12ADAM17MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207569-A1 Methods for the treatment of liver diseases CONATUS PHARMACEUTICALS, INC. 2008-08-28 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-20080207569-A1 Methods for the treatment of liver diseases MMP1, PYGL, MMP8 MMP2 8/4885MMP9 24/4885MMP12 33/4885

“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.