SCHEMBL4929374

SCHEMBL4929374

CSCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc2c(c1F)CCCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.43
CTSK P43235 3/20 0.43
CTSB P07858 1/20 0.43
P2RX7 Q99572 7/20 0.42
BACE1 P56817 2/20 0.41
KLK5 Q9Y337 1/20 0.41
KLK7 P49862 1/20 0.41
CA1 P00915 1/20 0.40
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
CTSS P25774 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CASP1 P29466 1/20 0.38
POLB P06746 1/20 0.38

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
Iodide SCHEMBL4927029 0.90 P2RX7 (0.42) CTSLCTSKCTSBP2RX7BACE1
SCHEMBL4930098 0.85 CTSL (0.47) CTSLCTSKCTSBP2RX7BACE1
SCHEMBL4169157 0.82 CTSL (0.47) CTSLCTSKCTSBP2RX7BACE1
SCHEMBL4638357 0.81 CTSL (0.43) CTSLCTSKCTSBKLK5KLK7
Iodide SCHEMBL4930438 0.80 CTSL (0.42) CTSLCTSKCTSBP2RX7BACE1
SCHEMBL4638362 0.76 CTSK (0.43) CTSLCTSKCTSBCA1FNTA
Iodide SCHEMBL4639203 0.76 TMEM97 (0.44) CTSLCTSKP2RX7BACE1CA1
SCHEMBL30889534 0.73 KLK5 (0.53) CTSLCTSKCTSBKLK5KLK7
SCHEMBL5386729 0.73 KLK5 (0.53) CTSLCTSKCTSBP2RX7KLK5
SCHEMBL3007640 0.71 KDM1A (0.49) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306045-A1 1-Benzazepine-3-Sulfonylamino-2-Pyrroridones as Factor Xa Inhibitors CAMUS LAURE 2008-12-11 US disclosed
US-20080306045-A1 1-Benzazepine-3-Sulfonylamino-2-Pyrroridones as Factor Xa Inhibitors CAMUS LAURE 2008-12-11 US disclosed
US-20080306045-A1 1-Benzazepine-3-Sulfonylamino-2-Pyrroridones as Factor Xa Inhibitors CAMUS LAURE 2008-12-11 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-20080306045-A1 1-Benzazepine-3-Sulfonylamino-2-Pyrroridones as Factor Xa Inhibitors TFPI, TPSAB1, TFPI2 CTSL 522/4885CTSK 406/4885CTSB 819/4885

“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.