SCHEMBL8250328

SCHEMBL8250328

O=C(NCC(=O)N1CCCC1B(O)O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PREP P48147 16/20 1.00
FAP Q12884 15/20 1.00
DPP4 P27487 12/20 1.00
DPP8 Q6V1X1 3/20 0.78
DPP9 Q86TI2 3/20 0.78
DPP7 Q9UHL4 2/20 0.60

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
SCHEMBL2306546 0.88 FAP (0.78) PREPFAPDPP4DPP8DPP9
SCHEMBL29362135 0.88 FAP (0.78) PREPFAPDPP4DPP8DPP9
SCHEMBL13377318 0.88 FAP (0.78) PREPFAPDPP4DPP8DPP9
SCHEMBL2308328 0.86 PREP (0.75) PREPFAPDPP4DPP8DPP9
SCHEMBL8253315 0.84 FAP (0.76) PREPFAPDPP4DPP8DPP9
SCHEMBL8286764 0.83 FAP (0.71) PREPFAPDPP4DPP8DPP9
SCHEMBL2307772 0.83 FAP (0.72) PREPFAPDPP4DPP8DPP9
SCHEMBL22811348 0.82 PREP (0.69) PREPFAPDPP4DPP7
SCHEMBL22209470 0.82 PREP (0.69) PREPFAPDPP4DPP7
SCHEMBL8250329 0.81 FAP (1.00) PREPFAPDPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100098633-A1 SELECTIVE SEPRASE INHIBITORS MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2010-04-22 US disclosed
US-20080280856-A1 Fibroblast Activation Protein Inhibitor Compounds and Methods GENENTECH, INC. (US) 2008-11-13 US disclosed
US-20080280856-A1 Fibroblast Activation Protein Inhibitor Compounds and Methods GENENTECH, INC. (US) 2008-11-13 US disclosed
US-7399869-B2 N-blocked peptide proline boronate compounds; hyperproliferative disorders like cancer, neurodegeneration, cardiac hypertrophy, pain, migraine, neurotraumatic disease, cirrhosis, fibromatosis, and rheumatoid arthritis GENENTECH, INC. (US) 2008-07-15 US disclosed
US-7399869-B2 N-blocked peptide proline boronate compounds; hyperproliferative disorders like cancer, neurodegeneration, cardiac hypertrophy, pain, migraine, neurotraumatic disease, cirrhosis, fibromatosis, and rheumatoid arthritis GENENTECH, INC. (US) 2008-07-15 US disclosed
WO-2006125227-A2 FIBROBLAST ACTIVATION PROTEIN INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2006-11-23 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 (2 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-20100098633-A1 SELECTIVE SEPRASE INHIBITORS SLC6A7, DNPEP, PREP PREP 3/4885FAP 4/4885DPP4 472/4885
US-20080280856-A1 Fibroblast Activation Protein Inhibitor Compounds and Methods FAP, FIBP, FGFR1 PREP 23/4885FAP 1/4885DPP4 305/4885

“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.