SCHEMBL3071037

SCHEMBL3071037

O=C(c1nc2c(C(F)(F)F)cccn2c1Cl)N1CCC(N2CCOC2=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 9/20 0.39
VNN1 O95497 1/20 0.38
F10 P00742 1/20 0.38
MGLL Q99685 1/20 0.37
P2RX7 Q99572 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
HSD11B1 P28845 1/20 0.35
SCD5 Q86SK9 1/20 0.35
LMNA P02545 1/20 0.34
CHRM1 P11229 1/20 0.34
USP7 Q93009 1/20 0.34

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
SCHEMBL3061546 0.85 F10 (0.40) RBP4VNN1F10MGLLTRPV1
SCHEMBL3053754 0.84 SCD5 (0.39) RBP4VNN1F10MGLLTRPV1
SCHEMBL3063204 0.84 P2RX7 (0.43) RBP4VNN1F10MGLLP2RX7
SCHEMBL3058815 0.84 F10 (0.37) RBP4VNN1F10MGLLP2RX7
SCHEMBL3063342 0.84 VNN1 (0.37) RBP4VNN1F10TRPV1HSD11B1
SCHEMBL3063817 0.84 F10 (0.39) RBP4VNN1F10MGLLP2RX7
SCHEMBL3071149 0.83 F10 (0.37) RBP4VNN1F10TRPV1HSD11B1
SCHEMBL3066610 0.82 F10 (0.38) RBP4VNN1F10MGLLP2RX7
SCHEMBL3071230 0.82 F10 (0.36) RBP4VNN1F10P2RX7TRPV1
SCHEMBL3058543 0.82 VNN1 (0.38) RBP4VNN1F10MGLLP2RX7

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 4 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 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

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.