SCHEMBL3589002

SCHEMBL3589002

COCC(=O)N(C)c1ccc(NC(=O)[C@H]2C[C@@H](O)CN2C(=O)Nc2ccc(Cl)cc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.51
POLB P06746 1/20 0.47
KLKB1 P03952 5/20 0.40
CCR1 P32246 1/20 0.36

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
SCHEMBL3582467 0.90 F10 (0.48) F10POLBKLKB1CCR1
SCHEMBL3580388 0.90 POLB (0.55) F10POLBKLKB1CCR1
SCHEMBL3589004 0.83 F10 (0.52) F10POLBKLKB1
SCHEMBL3577875 0.83 F10 (0.57) F10POLBKLKB1
SCHEMBL3580372 0.82 POLB (0.54) F10POLBKLKB1CCR1
SCHEMBL3577870 0.81 POLB (0.52) F10POLBKLKB1CCR1
SCHEMBL3582631 0.81 POLB (0.55) F10POLBKLKB1CCR1
SCHEMBL3589240 0.80 POLB (0.50) F10POLBKLKB1CCR1
SCHEMBL3581948 0.80 POLB (0.53) F10POLBKLKB1CCR1
SCHEMBL3580417 0.80 POLB (0.55) F10POLBKLKB1CCR1

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-1697318-B1 PROLINYLARYLACETAMIDES MERCK PATENT GMBH (DE) 2008-08-27 EP claimed
US-20070185189-A1 Prolinylarylacetamides MERCK PATENT GMBH (DE) 2007-08-09 US claimed
US-7732481-B2 Prolinylarylacetamides MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-06-08 US disclosed
US-20070185189-A1 Prolinylarylacetamides MERCK PATENT GMBH (DE) 2007-08-09 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-20070185189-A1 Prolinylarylacetamides F12, F11, F2 F10 5/4885POLB 3435/4885KLKB1 1086/4885

“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.