SCHEMBL6131684

SCHEMBL6131684

CCOC(=O)C(Cc1ccc(N)cc1)NC1=CC(=O)C12CCOCC2

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPID Q08752 3/20 0.41
ELANE P08246 2/20 0.38
PPIB P23284 2/20 0.36
PPIA P62937 1/20 0.36
PPIG Q13427 1/20 0.36
ITGB1 P05556 3/20 0.36
ITGA4 P13612 3/20 0.36
BACE1 P56817 1/20 0.33
CTSC P53634 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAOA P21397 1/20 0.33
POLB P06746 1/20 0.33
HPRT1 P00492 1/20 0.32
ITGB7 P26010 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL6131686 1.00 PPID (0.41) PPIDELANEPPIBPPIAPPIG
SCHEMBL6131690 0.90 PPID (0.34) PPIDELANEITGB1ITGA4CTSC
SCHEMBL4750224 0.90 ITGB1 (0.44) PPIDELANEPPIBPPIAPPIG
SCHEMBL4750220 0.90 ITGB1 (0.44) PPIDELANEPPIBPPIAPPIG
SCHEMBL6131691 0.89 CTSC (0.34) PPIDITGB1ITGA4CTSCITGB7
SCHEMBL6131675 0.86 MAPT (0.37) ELANELMNA
SCHEMBL4734985 0.82 ITGB1 (0.43) ELANEITGB1ITGA4NPSR1PPARG
SCHEMBL4734251 0.82 PPID (0.46) PPIDELANEPPIBPPIAPPIG
SCHEMBL4734039 0.81 MMP1 (0.42) ELANE
SCHEMBL4734043 0.81 MMP1 (0.42) ELANE

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-6951943-B2 Process for the preparation of phenylalanine enamide derivatives CELLTECH R & D LIMITED (GB) 2005-10-04 US disclosed
US-20040073033-A1 Process for the preparation of phenylalanine enamide derivatives UCB PHARMA S.A. (BE) 2004-04-15 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-20040073033-A1 Process for the preparation of phenylalanine enamide derivatives NPY2R, NPY1R, NPR1 PPID 3167/4885ELANE 855/4885PPIB 2919/4885

“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.