SCHEMBL5569467

SCHEMBL5569467

CC(C)Oc1ccc(CN[C@H](CC(=O)O)Cc2ccc(-c3cn(C)c(C(C)(C)C)n3)cc2)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CENPE Q02224 1/20 0.39
S1PR1 P21453 6/20 0.38
P2RX3 P56373 9/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38
WDR5 P61964 1/20 0.37
KMO O15229 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL5569474 0.89 P2RX3 (0.39) S1PR1P2RX3S1PR3MEN1KMT2A
SCHEMBL2104873 0.87 CENPE (0.51) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL5569134 0.83 CENPE (0.39) CENPES1PR1P2RX3WDR5KMO
SCHEMBL13626786 0.80 CENPE (0.50) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL3468364 0.80 CENPE (0.50) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL2104831 0.80 CENPE (0.51) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL13161714 0.79 CENPE (0.54) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL3462435 0.79 CENPE (0.54) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL4876587 0.79 S1PR1 (0.39) CENPES1PR1P2RX3S1PR3S1PR5
SCHEMBL2104141 0.78 CENPE (0.42) CENPES1PR1P2RX3S1PR3S1PR5

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-20070219192-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-09-20 US claimed
US-20070219192-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-09-20 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-20070219192-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 CENPE 54/4885S1PR1 2943/4885P2RX3 4199/4885

“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.