SCHEMBL5499207

SCHEMBL5499207

COC(=O)C(Oc1c[c]ccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
KLK7 P49862 1/20 0.41
CHRM1 P11229 1/20 0.41
PPARA Q07869 1/20 0.40
F9 P00740 1/20 0.40
F10 P00742 1/20 0.40
PLAU P00749 1/20 0.40
MEN1 O00255 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37

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
SCHEMBL5505288 0.85 KDM4E (0.49) KMT2AALDH1A1KDM4EHPGDCHRM1
SCHEMBL8668868 0.85 KMT2A (0.58) KMT2AALDH1A1KDM4EHPGDKLK7
SCHEMBL7254510 0.80 ALDH1A1 (0.59) KMT2AALDH1A1KDM4EHPGDKLK7
SCHEMBL7209411 0.79 MEN1 (0.44) KMT2AALDH1A1KDM4EHPGDKLK7
SCHEMBL11563916 0.79 MAPK1 (0.50) KMT2AALDH1A1KDM4EHPGDCHRM1
SCHEMBL9044655 0.79 KMT2A (0.51) KMT2AALDH1A1KDM4EHPGDKLK7
SCHEMBL12260841 0.78 KMT2A (0.50) KMT2AALDH1A1KDM4EHPGDKLK7
SCHEMBL8017865 0.78 KDM4E (0.54) KMT2AALDH1A1KDM4EHPGDKLK7
SCHEMBL27260909 0.77 KMT2A (0.49) KMT2AALDH1A1KDM4EHPGDCHRM1
SCHEMBL9130859 0.76 KMT2A (0.47) KMT2AALDH1A1KDM4EHPGDCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786421-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-05-23 EP claimed
US-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US claimed
WO-2006017124-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-02-16 WO claimed
EP-1786421-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-05-23 EP disclosed
US-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US disclosed
WO-2006017124-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-02-16 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-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases PTPRO, PTPRG, PTPN1 KMT2A 2364/4885ALDH1A1 1227/4885KDM4E 858/4885

“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.