SCHEMBL2776937

SCHEMBL2776937

CCOC(=O)c1onc(-c2cccs2)c1CBr

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.47
ALDH1A1 P00352 7/20 0.47
HPGD P15428 6/20 0.47
GAA P10253 2/20 0.47
CASP1 P29466 1/20 0.47
MAPT P10636 5/20 0.46
TSHR P16473 3/20 0.46
KMT2A Q03164 1/20 0.46
PLK1 P53350 1/20 0.45
NPSR1 Q6W5P4 6/20 0.44
HSD17B10 Q99714 4/20 0.44
PKM P14618 2/20 0.44
KEAP1 Q14145 1/20 0.44
TP53 P04637 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HIF1A Q16665 1/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL2777497 0.85 ALDH1A1 (0.51) KDM4EALDH1A1HPGDGAACASP1
SCHEMBL2776180 0.80 GABRA5 (0.54) KDM4EALDH1A1HPGDMAPTTSHR
SCHEMBL2779037 0.79 PLK1 (0.45) ALDH1A1HPGDCASP1PLK1NPSR1
SCHEMBL2773522 0.76 KDM4E (0.47) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL2774299 0.75 ALDH1A1 (0.55) KDM4EALDH1A1HPGDCASP1MAPT
SCHEMBL2775338 0.75 TARBP2 (0.50) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL2776688 0.74 MEN1 (0.42) KDM4EALDH1A1HPGDGAACASP1
SCHEMBL2777919 0.72 MAPT (0.45) KDM4EALDH1A1HPGDGAACASP1
SCHEMBL508571 0.72 KMT2A (0.61) KDM4EALDH1A1HPGDGAACASP1
SCHEMBL3662567 0.71 ALDH1A1 (0.51) KDM4EALDH1A1HPGDCASP1MAPT

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 KDM4E 710/4885ALDH1A1 219/4885HPGD 23/4885

“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.