SCHEMBL6763191

SCHEMBL6763191

[C-]#[N+]c1cccc(Oc2ccc3c(c2)C[C@H](NC(=O)OC(C)(C)C)C(=O)N3OC(=O)OC(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 2/20 0.35
KYAT1 Q16773 1/20 0.35
KYAT3 Q6YP21 1/20 0.35
KDM1A O60341 1/20 0.33
NPY1R P25929 1/20 0.32
GHSR Q92847 4/20 0.31
CCKBR P32239 1/20 0.31
PYGL P06737 1/20 0.30
PYGM P11217 1/20 0.30
BRD4 O60885 2/20 0.30
GAA P10253 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
SCHEMBL6832251 0.85 RIPK1 (0.39) AADATKYAT1KYAT3PYGLPYGM
SCHEMBL6763244 0.81 PYGL (0.35) AADATKYAT1KYAT3KDM1ANPY1R
SCHEMBL6762670 0.79 AADAT (0.39) AADATKDM1ANPY1RCCKBRPYGL
SCHEMBL6763949 0.78 BACE1 (0.39) KDM1ANPY1RPYGLPYGMGAA
SCHEMBL6762978 0.75 AADAT (0.59) AADATKYAT1KYAT3NPY1RGHSR
SCHEMBL6763129 0.75 KMT2A (0.42) NPY1R
SCHEMBL3781776 0.74 CCKBR (0.39) AADATKYAT1KYAT3KDM1ACCKBR
SCHEMBL9886293 0.74 KDM1A (0.38) AADATKYAT1KYAT3KDM1ANPY1R
SCHEMBL3774235 0.74 HIF1A (0.36) AADATKYAT1KYAT3PYGLPYGM
SCHEMBL6763216 0.74 RIPK1 (0.36)

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 AADAT 2284/4885KYAT1 69/4885KYAT3 129/4885

“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.