SCHEMBL1776304

SCHEMBL1776304

CCOC(=O)c1c(-c2ccncc2)noc1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.57
POLB P06746 2/20 0.57
ALOX15 P16050 1/20 0.57
TSHR P16473 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.55
ATM Q13315 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
ALDH1A1 P00352 5/20 0.52
HPGD P15428 4/20 0.52
LMNA P02545 4/20 0.52
KDM4E B2RXH2 2/20 0.52
PTBP1 P26599 2/20 0.52
HSD17B10 Q99714 1/20 0.51
NPC1 O15118 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
GAA P10253 3/20 0.49
CYP3A4 P08684 2/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48

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
SCHEMBL2923610 0.87 ATM (0.64) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL536297 0.87 TSHR (0.74) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL3294932 0.86 POLB (0.57) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL14583 0.84 POLB (0.56) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL286034 0.84 ALDH1A1 (0.61) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL13674 0.84 CACNA1F (0.62) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL2776267 0.84 TSHR (0.70) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL286360 0.84 GPBAR1 (0.62) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL899450 0.84 POLB (0.56) MAPK1POLBALOX15TSHRL3MBTL1
SCHEMBL2780502 0.84 GPBAR1 (0.58) MAPK1POLBALOX15TSHRL3MBTL1

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
EP-2231651-B1 ISOXAZOLO-PYRIDAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2018-11-21 EP disclosed
EP-2767536-B1 Isoxazolo-pyridine derivatives HOFFMANN LA ROCHE (CH) 2015-09-02 EP disclosed
US-9073908-B2 Isoxazolo-pyridine derivatives ROCHE PALO ALTO LLC (US) 2015-07-07 US disclosed
EP-2227467-B1 ISOXAZOLO-PYRIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-12-31 EP disclosed
US-8877782-B2 Isoxazolo-pyridine derivatives ROCHE PALO ALTO LLC (US) 2014-11-04 US disclosed
US-8877783-B2 Isoxazolo-pyridine derivatives ROCHE PALO ALTO LLC (US) 2014-11-04 US disclosed
US-8846719-B2 Isoxazolo-pyridine derivatives ROCHE PALO ALTO LLC (US) 2014-09-30 US disclosed
EP-2767536-A1 ISOXAZOLO-PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2014-08-20 EP disclosed
US-20130281690-A1 ISOXAZOLO-PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2013-10-24 US disclosed
US-20130274467-A1 ISOXAZOLO-PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2013-10-17 US disclosed
US-7943619-B2 Isoxazolo-pyridazine derivatives HOFFMANN-LA ROCHE INC. (US) 2011-05-17 US disclosed
EP-2231651-A1 ISOXAZOLO-PYRIDAZINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-29 EP disclosed
EP-2227467-A1 ISOXAZOLO-PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-15 EP disclosed
WO-2009071477-A1 ISOXAZOLO-PYRIDAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-11 WO disclosed
WO-2009071476-A1 ISOXAZOLO-PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-11 WO disclosed
US-20090143385-A1 ISOXAZOLO-PYRIDAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
US-20090143371-A1 ISOXAZOLE-PYRIDINE DERIVATIVES ROCHE PALO ALTO LLC 2009-06-04 US disclosed
US-7053219-B2 Isoxazolopyridone derivatives and their use BANYU PHARMACEUTICAL CO. LTD. (JP) 2006-05-30 US disclosed
US-20040176407-A1 Novel isoxazolopyridone derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-09-09 US disclosed
EP-1408042-A1 NOVEL ISOXAZOLOPYRIDONE DERIVATIVES AND USE THEREOF BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-04-14 EP 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 (5 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-20090143371-A1 ISOXAZOLE-PYRIDINE DERIVATIVES GABRA5, GABRA1, CHRNA5 MAPK1 2735/4885POLB 3831/4885ALOX15 2796/4885
US-20090143385-A1 ISOXAZOLO-PYRIDAZINE DERIVATIVES GABRA5, CHRNA5, GABRA1 MAPK1 3025/4885POLB 2720/4885ALOX15 689/4885
US-20130274467-A1 ISOXAZOLO-PYRIDINE DERIVATIVES GABRA5, GABRA1, GABRA4 MAPK1 2784/4885POLB 3764/4885ALOX15 2541/4885
US-20130281690-A1 ISOXAZOLO-PYRIDINE DERIVATIVES GABRA5, GABRA1, GABRA4 MAPK1 2784/4885POLB 3764/4885ALOX15 2541/4885
US-20040176407-A1 Novel isoxazolopyridone derivatives and their use GRIN2A, GRM2, GRM1 MAPK1 1978/4885POLB 3731/4885ALOX15 3306/4885

“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.