SCHEMBL5354877

SCHEMBL5354877

ON=C(Cc1cccc(Cl)n1)c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.36
RAB9A P51151 2/20 0.36
GAA P10253 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
GRIN2B Q13224 1/20 0.34
SIGMAR1 Q99720 4/20 0.33
TMEM97 Q5BJF2 3/20 0.33
NFE2L2 Q16236 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
XDH P47989 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TLR4 O00206 1/20 0.32
NPC1 O15118 1/20 0.31

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
SCHEMBL5354872 1.00 DRD4 (0.36) DRD4RAB9AGAAALDH1A1LMNA
SCHEMBL5455414 0.85 GSK3B (0.33) RAB9AGAAALDH1A1KDM4ESMN1; SMN2
SCHEMBL5455411 0.85 GSK3B (0.33) RAB9AGAAALDH1A1KDM4ESMN1; SMN2
SCHEMBL5215255 0.84 GPBAR1 (0.36) RAB9AGAAALDH1A1LMNAGRIN2B
SCHEMBL5215249 0.84 GPBAR1 (0.36) RAB9AGAAALDH1A1LMNAGRIN2B
SCHEMBL5351152 0.82 SMN1; SMN2 (0.56) GAAALDH1A1LMNANFE2L2KDM4E
SCHEMBL5351150 0.82 SMN1; SMN2 (0.56) GAAALDH1A1LMNANFE2L2KDM4E
SCHEMBL5349959 0.79 RAB9A (0.59) RAB9AGAAALDH1A1LMNANFE2L2
SCHEMBL5452893 0.78 NOTUM (0.31)
SCHEMBL5452890 0.78 NOTUM (0.31)

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070287721-A1 Pyrazolopyridinyl pyridine BOYD F LESLIE 2007-12-13 US disclosed
US-7163940-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-16 US disclosed
US-7160897-B2 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-09 US disclosed
US-7109209-B2 Pyrazolopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-09-19 US disclosed
US-7087618-B2 Pyrazolopyridinyl pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-08-08 US disclosed
US-7034030-B2 Pyralopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-04-25 US disclosed
US-20060058319-A1 Pyrazolopyridines, process for their preparation and use as therapeutic compounds ALBERTI MICHAEL J 2006-03-16 US disclosed
US-20050182080-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2005-08-18 US disclosed
EP-1341788-B1 PYRAZOLOPYRIDINES GLAXO GROUP LTD (GB) 2005-08-10 EP disclosed
US-20050171133-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2005-08-04 US disclosed
US-20050049259-A1 Theraopeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-03-03 US disclosed
US-20040072853-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2004-04-15 US disclosed
EP-1377573-A2 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2004-01-07 EP disclosed
EP-1372643-A1 PYRAZOLOPYRIDINES, PROCESS FOR THEIR PREPARATION AND USE AS THERAPEUTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-01-02 EP disclosed
EP-1372642-A1 USE OF PYRAZOLOPYRIDINES AS THERAPEUTIC COMPOUNDS SmithKline Beecham Corporation (US) 2004-01-02 EP disclosed
EP-1341788-A2 PYRAZOLOPYRIDINES GLAXO GROUP LIMITED (GB) 2003-09-10 EP disclosed
WO-2002078700-A1 PYRALOPYRIDINES, PROCESS FOR THEIR PREPARATION AND USE AS THERAPTEUTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-10 WO disclosed
WO-2002078701-A1 USE OF PYRAZOLOPYRIDINES AS THERAPEUTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2002-10-10 WO disclosed
WO-2002048147-A2 PYRAZOLOPYRIDINES GLAXO GROUP LIMITED (GB) 2002-06-20 WO disclosed
WO-2002048148-A2 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2002-06-20 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 (6 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-20050049259-A1 Theraopeutic compounds PCSK9, FOLH1, EPHA2 DRD4 4575/4885RAB9A 2333/4885GAA 74/4885
US-20060058319-A1 Pyrazolopyridines, process for their preparation and use as therapeutic compounds CYP3A5, CYP3A4, CYP3A7 DRD4 1059/4885RAB9A 1295/4885GAA 769/4885
US-20070287721-A1 Pyrazolopyridinyl pyridine CYP3A5, CYP2C19, CYP3A4 DRD4 2270/4885RAB9A 1326/4885GAA 1465/4885
US-20040072853-A1 Therapeutic compounds PCSK9, ABCB1, FURIN DRD4 2179/4885RAB9A 1306/4885GAA 63/4885
US-20050182080-A1 Therapeutic compounds PCSK9, FURIN, CYP11B2 DRD4 2118/4885RAB9A 1444/4885GAA 62/4885
US-20050171133-A1 Therapeutic compounds PCSK9, FURIN, CYP11B2 DRD4 2118/4885RAB9A 1444/4885GAA 62/4885

“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.