SCHEMBL2776598

SCHEMBL2776598

CCOC(=O)c1nc(-c2ccccc2)c2onc(C)c2c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.48
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 2/20 0.46
TARBP2 Q15633 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KMT2A Q03164 1/20 0.45
GABRA5 P31644 1/20 0.44
SLC26A6 Q9BXS9 3/20 0.44
MAPK1 P28482 1/20 0.44
ATM Q13315 1/20 0.44
CACNA1F O60840 1/20 0.43
CACNA1D Q01668 1/20 0.43

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
SCHEMBL2774268 0.92 ALDH1A1 (0.47) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2776664 0.87 CDC7 (0.50) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2775657 0.86 ADORA3 (0.48) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2773604 0.84 NPC1 (0.47) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2777413 0.84 ADORA3 (0.48) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2774171 0.83 TARBP2 (0.46) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2775360 0.82 GABRA5 (0.42) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2777401 0.82 TARBP2 (0.45) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2
SCHEMBL2776033 0.81 ALDH1A1 (0.41) ALDH1A1HSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL2776301 0.81 TARBP2 (0.46) ADORA3ALDH1A1HSD17B10TARBP2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2227475-B1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS FIBROGEN INC (US) 2014-02-19 EP disclosed
US-8269008-B2 Oxazolopyridine and isoxazolopyridine derivatives for use in the treatment of HIF-mediated conditions FIBROGEN, INC. (US) 2012-09-18 US disclosed
US-20100303928-A1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS FIBROGEN, INC. (US) 2010-12-02 US disclosed
EP-2227475-A1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS Fibrogen, Inc. (US) 2010-09-15 EP disclosed
WO-2009073669-A1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS FIBROGEN, INC. (US) 2009-06-11 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-20100303928-A1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS HIF1AN, HIF1A, EGLN2 ADORA3 2518/4885ALDH1A1 219/4885HSD17B10 1631/4885

“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.