SCHEMBL4082186

SCHEMBL4082186

CCOC(=O)c1ccnc(OCCOCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 5/20 0.47
PPIA P62937 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PIK3CA P42336 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LNPEP Q9UIQ6 1/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41

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
SCHEMBL4090687 0.79 JMJD6 (0.51) JMJD6PIK3CAKMT2ACYP4F2CYP4A11
SCHEMBL3723629 0.79 JMJD6 (0.56) JMJD6PIK3CA
SCHEMBL4087566 0.78 JMJD6 (0.50) JMJD6PIK3CA
SCHEMBL5550995 0.76 HPGD (0.59) JMJD6PPIASMN1; SMN2NPC1RAB9A
SCHEMBL29505420 0.76 MAOB (0.58) JMJD6SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL19510738 0.76 MAOB (0.58) JMJD6SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL8279879 0.75 MAOB (0.44) SMN1; SMN2MAPTRAB9AL3MBTL1LNPEP
SCHEMBL7456502 0.75 JMJD6 (0.55) JMJD6PIK3CA
SCHEMBL21924198 0.74 MEN1 (0.57) SMN1; SMN2ALDH1A1L3MBTL1MEN1HSP90AA1
SCHEMBL21924312 0.74 MEN1 (0.57) SMN1; SMN2ALDH1A1L3MBTL1MEN1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1847533-B1 SIX-MEMBERED HETEROCYCLIC COMPOUND AND THE USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2013-08-14 EP disclosed
US-7531533-B2 6-Membered heterocyclic compound and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-05-12 US disclosed
EP-1847533-A1 SIX-MEMBERED HETEROCYCLIC COMPOUND AND THE USE THEREOF Asahi Kasei Pharma Corporation (JP) 2007-10-24 EP disclosed
US-20070060590-A1 6-Membered heterocyclic compound and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2007-03-15 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-20070060590-A1 6-Membered heterocyclic compound and use thereof WNT1, CYP11B2, CYP11B1 JMJD6 1861/4885PPIA 3182/4885SMN1; SMN2 951/4885

“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.