SCHEMBL3059079

SCHEMBL3059079

CC(C)c1cc(C(F)(F)F)c2nc(C(=O)N3CCC(N4CCOC4=O)CC3)cn2c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 9/20 0.37
VNN1 O95497 1/20 0.37
F10 P00742 2/20 0.35
MGLL Q99685 1/20 0.35
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PDE7A Q13946 1/20 0.33
MCHR1 Q99705 1/20 0.32
NPY5R Q15761 1/20 0.32
KDM5A P29375 1/20 0.32
SCD5 Q86SK9 1/20 0.32
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL3074613 0.83 F10 (0.37) RBP4VNN1F10MGLLPDE7A
SCHEMBL3076986 0.81 RBP4 (0.39) RBP4VNN1F10MCHR1NPY5R
SCHEMBL3075114 0.77 F10 (0.39) RBP4VNN1F10MGLLPDE7A
SCHEMBL3063226 0.77 F10 (0.39) VNN1F10MGLLPDE7AMCHR1
SCHEMBL3066610 0.75 F10 (0.38) RBP4VNN1F10MGLLPDE7A
SCHEMBL3063342 0.73 VNN1 (0.37) RBP4VNN1F10PDE7AMCHR1
SCHEMBL3064185 0.72 F10 (0.38) RBP4VNN1F10MGLLPDE7A
SCHEMBL3063774 0.72 F10 (0.38) RBP4VNN1F10MGLLPDE7A
SCHEMBL3061546 0.72 F10 (0.40) RBP4VNN1F10MGLLPDE7A
SCHEMBL3071149 0.72 F10 (0.37) RBP4VNN1F10PDE7AMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US claimed
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US disclosed
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US disclosed
WO-2010091411-A1 PIPERIDINYL CYCLIC AMIDO ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2010-08-12 WO disclosed
WO-2010091411-A1 PIPERIDINYL CYCLIC AMIDO ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2010-08-12 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-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents ZC3HAV1, MAVS, EIF2AK2 RBP4 2908/4885VNN1 1145/4885F10 2944/4885

“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.