SCHEMBL3469159

SCHEMBL3469159

CC(C)Oc1ccc(C(=O)NC(CCO)Cc2ccc(NC(=O)c3ccncc3)cc2)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CENPE Q02224 3/20 0.51
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ROCK2 O75116 1/20 0.46
PRKACA P17612 1/20 0.46
RPS6KB1 P23443 1/20 0.46
IRAK1 P51617 1/20 0.46
PRKX P51817 1/20 0.46
LIMK1 P53667 1/20 0.46
PRKG2 Q13237 1/20 0.46
ROCK1 Q13464 1/20 0.46
PRKG1 Q13976 1/20 0.46
PKN2 Q16513 1/20 0.46

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
SCHEMBL2101923 1.00 CENPE (0.51) CENPEMEN1KMT2ALMNAHPGD
SCHEMBL2106289 0.92 CENPE (0.53) CENPEMEN1KMT2AHPGDALDH1A1
SCHEMBL4561631 0.91 CENPE (0.49) CENPEMEN1KMT2ALMNAHPGD
SCHEMBL2105954 0.91 CENPE (0.61) CENPEMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL4440209 0.91 CENPE (0.43) CENPEMEN1KMT2ALMNAHPGD
SCHEMBL2104926 0.89 CENPE (0.56) CENPEMEN1KMT2ALMNAHPGD
SCHEMBL4769873 0.89 SCD (0.45) MEN1KMT2ALMNAHPGDSMN1; SMN2
SCHEMBL2101183 0.89 CENPE (0.59) CENPEMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL4767530 0.86 CENPE (0.58) CENPEMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL2104968 0.86 CENPE (0.58) CENPEMEN1KMT2AHPGDSMN1; SMN2

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-7795448-B2 Imidazoyl-benzamide anti-cancer agents CYTOKINETICS, INCORPORATED (US) 2010-09-14 US disclosed
US-20070197481-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-08-23 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-20070197481-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 CENPE 54/4885MEN1 1302/4885KMT2A 1501/4885

“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.