SCHEMBL7090972

SCHEMBL7090972

Nc1cccc(C(=O)N2CCCCC2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.66
KDM4E B2RXH2 1/20 0.66
CA12 O43570 1/20 0.62
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
CA7 P43166 1/20 0.62
CA9 Q16790 1/20 0.62
CA14 Q9ULX7 1/20 0.62
LMNA P02545 1/20 0.60
POLB P06746 1/20 0.60
ALDH1A1 P00352 4/20 0.59
MGLL Q99685 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
USP2 O75604 1/20 0.56
GAA P10253 2/20 0.55
MEN1 O00255 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD11B1 P28845 1/20 0.54
L3MBTL3 Q96JM7 2/20 0.54

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
SCHEMBL1877596 0.98 KDM4E (0.68) HPGDKDM4ECA12CA1CA2
Hydrochloric Acid SCHEMBL7128756 0.97 KDM4E (0.66) HPGDKDM4ECA12CA1CA2
SCHEMBL15271489 0.95 CA12 (0.64) HPGDKDM4ECA12CA1CA2
SCHEMBL7127339 0.87 HPGD (0.77) HPGDKDM4ELMNAPOLBALDH1A1
SCHEMBL12156532 0.85 L3MBTL3 (0.79) L3MBTL3L3MBTL1
SCHEMBL10720984 0.85 HPGD (0.76) HPGDKDM4ELMNAPOLBALDH1A1
SCHEMBL3093793 0.85 CA12 (0.65) HPGDKDM4ECA12CA1CA2
SCHEMBL4041012 0.85 CA12 (0.58) HPGDKDM4ECA12CA1CA2
SCHEMBL30568869 0.83 L3MBTL1 (0.62) HPGDKDM4ECA12CA1CA2
SCHEMBL520393 0.83 L3MBTL1 (0.62) HPGDKDM4ECA12CA1CA2

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
CN-118326693-A Antibacterial functional fabric and preparation method thereof 河北宝盛纺织品有限公司 2024-07-12 CN claimed
CN-118326693-A Antibacterial functional fabric and preparation method thereof 河北宝盛纺织品有限公司 2024-07-12 CN disclosed
EP-3319955-B1 6-AMINO-QUINOLINE-3-CARBONITRILS AS COT MODULATORS GILEAD SCIENCES INC (US) 2020-11-25 EP disclosed
EP-1928236-B1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC (BM) 2011-11-23 EP disclosed
EP-2065369-A1 UREA COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-06-03 EP disclosed
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED 2008-07-24 US disclosed
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED 2008-07-24 US disclosed
CN-1149195-C 5-HTIF agonists 2004-05-12 CN disclosed
US-6638921-B1 Pharmaceutically acceptable derivatives thereof Cx, R1 and R2 being as defined in the disclosure may be used to inhibit the activity of HIV integrase. PHARMACOR INC. (CA) 2003-10-28 US disclosed
WO-2003082881-A2 PYRIDOXAL-5-PHOSPHATE DERIVATIVES AS HIV INTEGRASE INHIBITORS PROCYON BIOPHARMA INC. (CA) 2003-10-09 WO disclosed
CN-1340045-A 5-HTIF agonists LILLY CO ELI (US) 2002-03-13 CN 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-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors PDE5A, PDE3B, PDE4A HPGD 276/4885KDM4E 818/4885CA12 2746/4885

“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.