SCHEMBL7250673

SCHEMBL7250673

CC(=O)N(c1ccncc1)[C@@H](CC(C)C)C(=O)NCC(=O)CNS(=O)(=O)c1ccccc1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 6/20 0.39
▸ CTSS P25774 2/20 0.36
▸ CTSL P07711 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ NAMPT P43490 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ BRD4 O60885 1/20 0.32
▸ AAK1 Q2M2I8 1/20 0.32
▸ ANPEP P15144 1/20 0.32
▸ PPIA P62937 1/20 0.32
▸ GPBAR1 Q8TDU6 3/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 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
SCHEMBL7241696 0.81 CTSK (0.41) CTSKMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL7159422 0.80 CTSK (0.56) CTSKCTSSALDH1A1SMN1; SMN2
SCHEMBL7255553 0.80 CTSK (0.47) CTSKCTSSCTSLANPEP
SCHEMBL7164798 0.79 CTSK (0.39) CTSKCTSSCTSLL3MBTL1NAMPT
SCHEMBL7169622 0.79 CTSK (0.45) CTSKMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL7163217 0.76 CTSK (0.56) CTSKCTSSCTSL
SCHEMBL7165070 0.76 CTSK (0.45) CTSKCTSSCTSLANPEP
SCHEMBL7338790 0.71 CTSK (0.47) CTSKCTSSCTSLMEN1ALDH1A1
SCHEMBL7249673 0.70 KMT2A (0.45) CTSKCTSSCTSLMEN1ALDH1A1
SCHEMBL7168553 0.68 CTSK (0.42) CTSKCTSSALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020156280-A1 Substituted 4-oxo-napthyridine-3-carboxamides: GABA brain receptor ligands NEUROGEN CORPORATION, CORPORATION OF THE STATE OF DELAWARE 2002-10-24 — — US claimed
US-6399604-B1 ANXIETY, DOWN SYNDROME, SLEEP, COGNITIVE AND SEIZURE DISORDERS, AND OVERDOSE WITH BENZODIAZEPINE DRUGS NEUROGEN CORPORATION 2002-06-04 — — US claimed
US-6143760-A Substituted 4-oxo-napthyridine-3-carboxamides: GABA brain receptor ligands NEUROGEN CORPORATION (US) 2000-11-07 — — US claimed
US-6646124-B2 Gamma-aminobutyric acid (GABA) agonists, antagonists or inverse agonists; treatment of anxiety, Down Syndrome, sleep, cognitive and seizure disorders, and overdose with benzodiazepine drugs NEUROGEN CORPORATION 2003-11-11 — — US disclosed
US-20020156280-A1 Substituted 4-oxo-napthyridine-3-carboxamides: GABA brain receptor ligands NEUROGEN CORPORATION, CORPORATION OF THE STATE OF DELAWARE 2002-10-24 — — US disclosed
US-6399604-B1 ANXIETY, DOWN SYNDROME, SLEEP, COGNITIVE AND SEIZURE DISORDERS, AND OVERDOSE WITH BENZODIAZEPINE DRUGS NEUROGEN CORPORATION 2002-06-04 — — US disclosed
US-6331542-B1 TREATING DISEASES CHARACTERIZED BY BONE LOSS OR EXCESSIVE CARTILAGE OR MATRIX DEGRADATION SMITHKLINE BEECHAM CORPORATION 2001-12-18 — — US disclosed
US-6143760-A Substituted 4-oxo-napthyridine-3-carboxamides: GABA brain receptor ligands NEUROGEN CORPORATION (US) 2000-11-07 — — US disclosed
EP-0934291-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1999-08-11 — — EP disclosed
EP-0934291-A4 — SMITHKLINE BEECHAM CORP (US) 1999-08-11 — — EP disclosed
WO-1997016433-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1997-05-09 — — 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 (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-20020156280-A1 Substituted 4-oxo-napthyridine-3-carboxamides: GABA brain receptor ligands GABRA4, GABRA1, GABRA2 CTSK 4336/4885CTSS 2709/4885CTSL 3809/4885

“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.

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