SCHEMBL5212307

SCHEMBL5212307

O=C(Cc1cccc(Cl)n1)c1cccnc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLOD2 O00469 2/20 0.50
PLOD3 O60568 1/20 0.46
PLOD1 Q02809 1/20 0.46
ALDH1A1 P00352 5/20 0.45
GAA P10253 2/20 0.45
APP P05067 1/20 0.45
HCAR3 P49019 1/20 0.45
HCAR2 Q8TDS4 1/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
SARM1 Q6SZW1 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
SIRT6 Q8N6T7 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
SIRT3 Q9NTG7 1/20 0.44

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
SCHEMBL5209337 0.83 RAB9A (0.49) PLOD2PLOD3PLOD1ALDH1A1GAA
SCHEMBL20354419 0.81 PLOD2 (0.49) PLOD2PLOD3PLOD1ALDH1A1GAA
SCHEMBL5212495 0.80 NPC1 (0.38) PLOD2ALDH1A1GAAAPPHCAR3
SCHEMBL5212496 0.80 NPC1 (0.38) PLOD2ALDH1A1GAAAPPHCAR3
SCHEMBL19203282 0.78 CA12 (0.43) ALDH1A1GAAKDM4EMEN1KMT2A
SCHEMBL10414580 0.77 RAB9A (0.60) PLOD2PLOD3PLOD1ALDH1A1GAA
SCHEMBL5943201 0.77 SMN1; SMN2 (0.46) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL5349959 0.76 RAB9A (0.59) PLOD2ALDH1A1GAAMEN1KMT2A
SCHEMBL5455921 0.76 RAB9A (0.48) ALDH1A1GAAMEN1KMT2AHDAC1
SCHEMBL31692743 0.75 PLOD2 (0.49) PLOD2PLOD3PLOD1ALDH1A1GAA

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
EP-1453830-B1 PYRAZOLO-PYRIDINE DERIVATIVES AS ANTIHERPES AGENTS SMITHKLINE BEECHAM CORP (US) 2007-09-12 EP disclosed
US-20070161653-A1 Pyrazolo-Pyridine Derivatives As Antiherpes Agents GUDMUNDSSON KRISTJAN 2007-07-12 US disclosed
US-7199120-B2 Pyrazolo-pyridine derivatives as antiherpes agents SMITHKLINE BEECHAM CORPORATION (US) 2007-04-03 US disclosed
US-20040248903-A1 Pyrazolo-pyridine derivatives as antiherpes agents SMITHKLINE BEECHAM CORPORATION 2004-12-09 US disclosed
EP-1453830-A1 PYRAZOLO-PYRIDINE DERIVATIVES AS ANTIHERPES AGENTS SmithKline Beecham Corporation (US) 2004-09-08 EP disclosed
WO-2003050120-A1 PYRAZOLO-PYRIDINE DERIVATIVES AS ANTIHERPES AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2003-06-19 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-20070161653-A1 Pyrazolo-Pyridine Derivatives As Antiherpes Agents HRH4, HRH2, HRH1 PLOD2 1719/4885PLOD3 1638/4885PLOD1 2203/4885
US-20040248903-A1 Pyrazolo-pyridine derivatives as antiherpes agents HRH4, HRH1, HRH2 PLOD2 1874/4885PLOD3 1939/4885PLOD1 2174/4885

“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.