SCHEMBL2775971

SCHEMBL2775971

CCOC(=O)c1nc(C#Cc2ccccc2)c2c(-c3ccccc3)noc2c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.45
GRM5 P41594 1/20 0.42
TARBP2 Q15633 1/20 0.41
CACNA1F O60840 1/20 0.41
CACNA1D Q01668 1/20 0.41
CACNA1S Q13698 1/20 0.41
CACNA1C Q13936 1/20 0.41
GABRA5 P31644 1/20 0.40
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 3/20 0.40
HSD17B10 Q99714 2/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL3659679 0.95 ADORA3 (0.42) ADORA3GRM5TARBP2CACNA1FCACNA1D
SCHEMBL2781293 0.90 TARBP2 (0.41) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2780208 0.88 TARBP2 (0.42) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2777413 0.84 ADORA3 (0.48) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2776301 0.83 TARBP2 (0.46) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2774203 0.82 TARBP2 (0.45) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2776836 0.82 KDM4E (0.46) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2774268 0.81 ALDH1A1 (0.47) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2778440 0.81 TARBP2 (0.43) ADORA3TARBP2CACNA1FCACNA1DCACNA1S
SCHEMBL2775921 0.80 EGLN1 (0.47)

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 3 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

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 2518/4885GRM5 1898/4885TARBP2 4814/4885

“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.