SCHEMBL5569230

SCHEMBL5569230

CC(C)Oc1ccc(C(=O)NN(Cc2ccc(-c3c[nH]c(CC(C)(C)C)n3)cc2)Cc2ccccc2O)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CENPE Q02224 2/20 0.37
KIFC1 Q9BW19 1/20 0.36
S1PR1 P21453 12/20 0.34
KMO O15229 2/20 0.33
WDR5 P61964 1/20 0.33
P2RX3 P56373 2/20 0.32

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
SCHEMBL2104386 0.82 CENPE (0.42) CENPEKIFC1S1PR1WDR5P2RX3
SCHEMBL4722945 0.81 CENPE (0.38) CENPEKIFC1S1PR1WDR5P2RX3
SCHEMBL2630625 0.80 CENPE (0.41) CENPEKIFC1S1PR1KMOWDR5
SCHEMBL2105714 0.77 KIFC1 (0.38) CENPEKIFC1S1PR1KMOWDR5
SCHEMBL4835982 0.75 CENPE (0.46) CENPEKIFC1S1PR1KMOWDR5
SCHEMBL13456835 0.74 CENPE (0.37) CENPEKIFC1S1PR1KMOWDR5
SCHEMBL2104984 0.69 CENPE (0.41) CENPEKIFC1S1PR1KMOP2RX3
SCHEMBL2104183 0.69 CENPE (0.40) CENPEKIFC1S1PR1KMOWDR5
SCHEMBL2104482 0.68 HPSE (0.46)
SCHEMBL2105148 0.68 CENPE (0.40) CENPEKIFC1S1PR1P2RX3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070149516-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-28 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-20070149516-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 CENPE 54/4885KIFC1 4/4885S1PR1 2943/4885

“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.