SCHEMBL1028972

SCHEMBL1028972

Cc1nnc(-c2ccc(C)c(N(CC(=O)O)CC(=O)N(C)N3Cc4ccccc4C3)c2)s1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AHCY P23526 4/20 0.36
GSK3B P49841 15/20 0.35
DYRK1A Q13627 15/20 0.35
WNT1 P04628 8/20 0.34

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
SCHEMBL1027761 0.86 AHCY (0.36) AHCYDYRK1A
SCHEMBL11975575 0.86 AHCY (0.54) AHCYGSK3BDYRK1AWNT1
SCHEMBL1026836 0.85 TACR3 (0.40) AHCY
SCHEMBL11974051 0.85 AHCY (0.44) AHCYGSK3BDYRK1AWNT1
SCHEMBL1028388 0.83 ALDH1A1 (0.38) AHCY
SCHEMBL1024176 0.83 GSK3B (0.37) GSK3BDYRK1AWNT1
SCHEMBL1027792 0.83 AHCY (0.40) AHCY
SCHEMBL1025570 0.82 AHCY (0.38) AHCY
SCHEMBL1024160 0.82 MAPK14 (0.40) AHCYGSK3BDYRK1A
SCHEMBL1026250 0.82 CNR1 (0.40) AHCY

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
US-8513235-B2 Homocysteine synthase inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-20 US disclosed
EP-2486925-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION Mitsubishi Tanabe Pharma Corporation (JP) 2012-08-15 EP disclosed
US-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-08-02 US disclosed
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-02-10 US disclosed
EP-2275404-A1 HOMOCYSTEINE SYNTHASE INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2011-01-19 EP 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-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION FABP7, TIMP3, MMP11 AHCY 4108/4885GSK3B 953/4885DYRK1A 4192/4885
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR BHMT, CBS, BHMT2 AHCY 4/4885GSK3B 2111/4885DYRK1A 4082/4885

“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.