SCHEMBL4026748

SCHEMBL4026748

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

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.34
MGLL Q99685 7/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PARP1 P09874 1/20 0.31

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
SCHEMBL4026734 1.00 HPGDS (0.34) HPGDSMGLLMEN1KMT2APARP1
SCHEMBL4021956 0.91 PARP1 (0.32) HPGDSMGLLMEN1KMT2APARP1
SCHEMBL4022330 0.91 PARP1 (0.32) HPGDSMGLLMEN1KMT2APARP1
SCHEMBL4022318 0.91 PARP1 (0.32) HPGDSMGLLMEN1KMT2APARP1
SCHEMBL4022804 0.88 KIF11 (0.33) MGLLPARP1
SCHEMBL4022792 0.88 KIF11 (0.33) MGLLPARP1
SCHEMBL4797014 0.84
SCHEMBL4022881 0.84 KIF11 (0.37) MGLL
SCHEMBL4022873 0.84 KIF11 (0.37) MGLL
SCHEMBL4019683 0.83 KIF11 (0.34) MGLL

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 3 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 claimed
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 HPGDS 17/4885MGLL 2929/4885MEN1 77/4885

“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.