SCHEMBL4022333

SCHEMBL4022333

Cc1c(F)cccc1C1C(C(=O)c2cccc(O)c2)CN(C(=O)N(C)CCN(C)C)CC1C(=O)c1cccc(O)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.36
KIF11 P52732 7/20 0.35
MGLL Q99685 9/20 0.35
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL13721155 1.00 BCHE (0.36) BCHEKIF11MGLLKCNH2HRH3
SCHEMBL4018821 1.00 BCHE (0.36) BCHEKIF11MGLLKCNH2HRH3
SCHEMBL4022425 0.95 KIF11 (0.42) BCHEKIF11MGLLKCNH2HRH3
SCHEMBL4020233 0.88 HSD11B1 (0.39) MGLL
SCHEMBL13721388 0.88 HSD11B1 (0.39) MGLL
SCHEMBL4020235 0.88 HSD11B1 (0.39) MGLL
SCHEMBL4019114 0.86 SIGMAR1 (0.38) BCHEMGLLOPRD1OPRK1
SCHEMBL4019124 0.86 SIGMAR1 (0.38) BCHEMGLLOPRD1OPRK1
SCHEMBL4029041 0.86 KDM4E (0.38) BCHEMGLLOPRD1OPRK1
SCHEMBL4021758 0.86 MGLL (0.36) BCHEKIF11MGLLOPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
EP-1962846-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-09-03 EP disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
WO-2007059323-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-24 WO 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 BCHE 1682/4885KIF11 3745/4885MGLL 2929/4885

“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.