SCHEMBL1008514

SCHEMBL1008514

O=C(O)C(CC1CCCC1)n1ncc(Oc2c(F)cccc2F)cc1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.38
LPAR5 Q9H1C0 5/20 0.38
EGLN1 Q9GZT9 2/20 0.35
EGLN2 Q96KS0 1/20 0.35
SCN9A Q15858 2/20 0.34
USP19 O94966 2/20 0.34
GPR132 Q9UNW8 1/20 0.33
FAAH O00519 1/20 0.33
TRPA1 O75762 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HIF1A Q16665 1/20 0.33
FFAR1 O14842 1/20 0.33
CCR5 P51681 1/20 0.33
MC4R P32245 1/20 0.33

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
SCHEMBL1008391 0.99 LPAR1 (0.37) LPAR1LPAR5EGLN1EGLN2SCN9A
SCHEMBL1007597 0.98 LPAR1 (0.38) LPAR1LPAR5EGLN1EGLN2SCN9A
SCHEMBL1008521 0.91 GCK (0.38) LPAR1LPAR5EGLN1EGLN2SCN9A
SCHEMBL1008126 0.89 EGLN1 (0.42) LPAR1LPAR5EGLN1SCN9AHIF1A
SCHEMBL1007288 0.89 LPAR1 (0.41) LPAR1LPAR5EGLN1EGLN2USP19
SCHEMBL1009234 0.88 LPAR1 (0.34) LPAR1LPAR5EGLN1MC4R
SCHEMBL1008428 0.87 ABL1 (0.38) CCR5
SCHEMBL1007983 0.86 P2RX3 (0.39) GPR132CCR5
SCHEMBL1009307 0.86 NPY5R (0.43) EGLN1GPR132FFAR1
SCHEMBL1008862 0.85 NPY5R (0.41) EGLN1GPR132

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
US-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
US-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
EP-2268633-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-05 EP disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
WO-2009127544-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-22 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-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS GCK, GCKR, PDXK LPAR1 4693/4885LPAR5 4405/4885EGLN1 3199/4885

“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.