SCHEMBL4028111

SCHEMBL4028111

Cc1c(F)cccc1C1C(C(=O)c2cccc(O)c2)CN(C(C)C(=O)N2CCN(C)CC2)CC1C(=O)c1cccc(O)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.38
NPC1 O15118 1/20 0.35
HRH4 Q9H3N8 4/20 0.34
MGLL Q99685 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ERN1 O75460 1/20 0.33
POLB P06746 1/20 0.33
KDM1A O60341 1/20 0.32
HTR1F P30939 1/20 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
SCHEMBL4021831 0.89 MAPT (0.33) SIGMAR1HRH4MGLLMEN1KMT2A
SCHEMBL4021829 0.89 MAPT (0.33) SIGMAR1HRH4MGLLMEN1KMT2A
SCHEMBL4019692 0.88 MAPT (0.33) SIGMAR1HRH4MGLLMEN1KMT2A
SCHEMBL4021994 0.88 MAPT (0.33) SIGMAR1HRH4MGLLMEN1KMT2A
SCHEMBL4019706 0.88 MAPT (0.33) SIGMAR1HRH4MGLLMEN1KMT2A
SCHEMBL4022008 0.88 MAPT (0.33) SIGMAR1HRH4MGLLMEN1KMT2A
SCHEMBL4021950 0.87 MGLL (0.33) SIGMAR1HRH4MGLLERN1KDM1A
SCHEMBL4019600 0.87 MGLL (0.33) SIGMAR1HRH4MGLLERN1KDM1A
SCHEMBL4019590 0.87 MGLL (0.33) SIGMAR1HRH4MGLLERN1KDM1A
SCHEMBL4021941 0.87 MGLL (0.33) SIGMAR1HRH4MGLLERN1KDM1A

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 SIGMAR1 3578/4885NPC1 263/4885HRH4 2504/4885

“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.