SCHEMBL6465753

SCHEMBL6465753

CC(C)COc1ccccc1C[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)N[C@H]1c2ccccc2C[C@H]1O

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VIPR2 P41587 19/20 0.58
MMP1 P03956 1/20 0.51
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51

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
SCHEMBL6465749 0.91 VIPR2 (0.60) VIPR2MMP2MMP9
SCHEMBL6464128 0.90 VIPR2 (0.59) VIPR2MMP1MMP2MMP9MMP8
SCHEMBL6464832 0.90 VIPR2 (0.65) VIPR2MMP1MMP2MMP9MMP8
SCHEMBL6466122 0.84 VIPR2 (0.69) VIPR2MMP1MMP2MMP9MMP8
SCHEMBL6468083 0.84 VIPR2 (0.62) VIPR2MMP2MMP9
SCHEMBL6469322 0.84 VIPR2 (0.64) VIPR2MMP1MMP2MMP9MMP8
SCHEMBL7300250 0.83 VIPR2 (0.70) VIPR2MMP1MMP2MMP9MMP8
SCHEMBL7300253 0.83 VIPR2 (0.70) VIPR2MMP1MMP2MMP9MMP8
SCHEMBL6465865 0.82 VIPR2 (0.61) VIPR2MMP9
SCHEMBL6463819 0.82 VIPR2 (0.67) VIPR2MMP1MMP2MMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038019-A1 Hydroxy substituted amides for the treatment of alzheimer's disease PHARMACIA & UPJOHN 2005-02-17 US claimed
US-20050038019-A1 Hydroxy substituted amides for the treatment of alzheimer's disease PHARMACIA & UPJOHN 2005-02-17 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-20050038019-A1 Hydroxy substituted amides for the treatment of alzheimer's disease BACE1, APP, BACE2 VIPR2 2131/4885MMP1 1095/4885MMP2 357/4885

“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.