SCHEMBL6832251

SCHEMBL6832251

CC(C)(C)OC(=O)N[C@H]1Cc2cc(Oc3cccc(C#N)c3)ccc2N(OC(=O)OC(C)(C)C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.39
RORC P51449 8/20 0.38
EPAS1 Q99814 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
KDM4D Q6B0I6 1/20 0.37
PYGL P06737 1/20 0.36
PYGM P11217 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
GRIA2 P42262 1/20 0.36
DRD2 P14416 1/20 0.36
BACE1 P56817 2/20 0.35
KYAT1 Q16773 1/20 0.35
KYAT3 Q6YP21 1/20 0.35
AADAT Q8N5Z0 1/20 0.35
NR1H2 P55055 1/20 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
SCHEMBL6763191 0.85 AADAT (0.35) PYGLPYGMKYAT1KYAT3AADAT
SCHEMBL5132913 0.84 KYAT1 (0.37) RIPK1RORCEPAS1PDE4APDE4B
SCHEMBL6763244 0.81 PYGL (0.35) PYGLPYGMDRD2KYAT1KYAT3
SCHEMBL3802539 0.81 CFTR (0.38) RIPK1PYGLPYGMPDE4APDE4B
SCHEMBL16613159 0.79 PYGL (0.36) RIPK1EPAS1SIRT2SIRT1KDM4D
SCHEMBL6762670 0.79 AADAT (0.39) PYGLPYGMDRD2AADAT
SCHEMBL6763949 0.78 BACE1 (0.39) RORCPYGLPYGMBACE1
SCHEMBL9886180 0.76 EPHX2 (0.36) KDM4DPYGLPYGMDRD2NR1H2
SCHEMBL6762978 0.75 AADAT (0.59) RIPK1KYAT1KYAT3AADAT
SCHEMBL6763129 0.75 KMT2A (0.42) RIPK1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183238-B2 Bicyclic and tricyclic compounds as KAT II inhibitors PFIZER INC. (US) 2012-05-22 US disclosed
US-20100324043-A1 Bicyclic And Tricyclic Compounds As KAT II Inhibitors PFIZER INC 2010-12-23 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-20100324043-A1 Bicyclic And Tricyclic Compounds As KAT II Inhibitors KAT2A, KAT2B, KAT6B RIPK1 761/4885RORC 2649/4885EPAS1 4738/4885

“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.