SCHEMBL3074539

SCHEMBL3074539

CC(=O)Nc1cc(C(F)(F)F)c2nc(C(=O)N3CCC(N4CCOC4=O)CC3)c(Cl)n2c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 1/20 0.37
F10 P00742 2/20 0.35
MCHR1 Q99705 1/20 0.35
NPY5R Q15761 1/20 0.33
RORC P51449 1/20 0.33
EPHX2 P34913 1/20 0.33
PDE7A Q13946 1/20 0.33
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.31
TRPV1 Q8NER1 2/20 0.31
HDAC4 P56524 1/20 0.31
RBP4 P02753 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PIK3CA P42336 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL3058543 0.87 VNN1 (0.38) VNN1F10MCHR1PDE7ATRPV1
SCHEMBL3063342 0.87 VNN1 (0.37) VNN1F10MCHR1NPY5RRORC
SCHEMBL3061546 0.87 F10 (0.40) VNN1F10NPY5RPDE7ATRPV1
SCHEMBL3068242 0.86 VNN1 (0.37) VNN1F10MCHR1NPY5RPDE7A
SCHEMBL3063817 0.85 F10 (0.39) VNN1F10MCHR1NPY5RPDE7A
SCHEMBL3058815 0.85 F10 (0.37) VNN1F10MCHR1NPY5RRORC
SCHEMBL3074613 0.85 F10 (0.37) VNN1F10MCHR1NPY5RRORC
SCHEMBL3063666 0.85 F10 (0.37) VNN1F10MCHR1PDE7ARBP4
SCHEMBL3074187 0.85 F10 (0.37) VNN1F10MCHR1NPY5RRORC
SCHEMBL3071149 0.85 F10 (0.37) VNN1F10MCHR1NPY5RPDE7A

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 6 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
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 VNN1 1145/4885F10 2944/4885MCHR1 4805/4885

“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.