SCHEMBL3072471

SCHEMBL3072471

O=C(c1nc2c(C(F)(F)F)cc(OC(F)F)cn2c1Cl)N1CCC(N2CCOC2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.38
VNN1 O95497 1/20 0.33
MCHR1 Q99705 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
LTA4H P09960 1/20 0.31
KCNH2 Q12809 1/20 0.31
RBP4 P02753 1/20 0.30
NPY5R Q15761 1/20 0.30
HSD11B1 P28845 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 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
SCHEMBL3064185 0.93 F10 (0.38) F10VNN1MCHR1TRPV1LTA4H
SCHEMBL3063666 0.90 F10 (0.37) F10VNN1MCHR1RBP4HSD11B1
SCHEMBL3063314 0.89 RBP4 (0.39) F10VNN1MCHR1LTA4HKCNH2
SCHEMBL3066610 0.87 F10 (0.38) F10VNN1MCHR1TRPV1RBP4
SCHEMBL3061546 0.87 F10 (0.40) F10VNN1TRPV1RBP4NPY5R
SCHEMBL3070842 0.86 OXTR (0.35)
SCHEMBL3063342 0.85 VNN1 (0.37) F10VNN1MCHR1TRPV1RBP4
SCHEMBL3058815 0.85 F10 (0.37) F10VNN1MCHR1TRPV1RBP4
SCHEMBL3063817 0.85 F10 (0.39) F10VNN1MCHR1TRPV1RBP4
SCHEMBL3074613 0.85 F10 (0.37) F10VNN1MCHR1TRPV1RBP4

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 F10 2944/4885VNN1 1145/4885MCHR1 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.