SCHEMBL3062268

SCHEMBL3062268

CCc1nc(C)c(C)c(C)c1O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL16301663 0.81 HTT (0.34) HTTKDM4EALDH1A1
SCHEMBL2454342 0.77 HTT (0.38) HTT
SCHEMBL15547333 0.76 HTT (0.36) HTTKDM4EALDH1A1
SCHEMBL15547941 0.73 TYR (0.40) KDM4EALDH1A1
SCHEMBL12788253 0.71 SRC (0.38)
SCHEMBL14734455 0.70 MEN1 (0.34) KDM4EALDH1A1
SCHEMBL9621372 0.70 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL8020079 0.70 MAPK1 (0.34) HTTKDM4EALDH1A1
SCHEMBL10393962 0.70 MAPK1 (0.34) HTT
SCHEMBL30689650 0.70 MAPK1 (0.34) HTTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014012593-A1 ALKYL SUBSTITUTED 3-HYDROXYPYRIDINES FOR THE TREATMENT OF DEPRESSION HandelsOrt AG (CH) 2014-01-23 WO claimed
EP-2231603-B1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH (RU) 2013-05-01 EP claimed
US-20120270908-A1 SUBSTITUTED 3 -HYDROZYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH (RU) 2012-10-25 US claimed
US-20100261764-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH 2010-10-14 US claimed
EP-2231603-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF Biryukov, Dmitri Valerievich (RU) 2010-09-29 EP claimed
WO-2009078746-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH (RU) 2009-06-25 WO claimed
WO-2014012593-A1 ALKYL SUBSTITUTED 3-HYDROXYPYRIDINES FOR THE TREATMENT OF DEPRESSION HandelsOrt AG (CH) 2014-01-23 WO disclosed
EP-2231603-B1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH (RU) 2013-05-01 EP disclosed
US-20120270908-A1 SUBSTITUTED 3 -HYDROZYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH (RU) 2012-10-25 US disclosed
US-20100261764-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH 2010-10-14 US disclosed
EP-2231603-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF Biryukov, Dmitri Valerievich (RU) 2010-09-29 EP disclosed
WO-2009078746-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIRYUKOV DMITRI VALERIEVICH (RU) 2009-06-25 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 (2 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-20100261764-A1 SUBSTITUTED 3 -HYDROXYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF GPR119, INSR, IGF1R HTT 1615/4885KDM4E 1555/4885ALDH1A1 1574/4885
US-20120270908-A1 SUBSTITUTED 3 -HYDROZYPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF GPR119, INSR, IGF1R HTT 842/4885KDM4E 4009/4885ALDH1A1 2006/4885

“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.