SCHEMBL3053754

SCHEMBL3053754

O=C(c1nc2c(C(F)(F)F)cc(-c3ccccc3)cn2c1Cl)N1CCC(N2CCOC2=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 2/20 0.39
USP2 O75604 1/20 0.39
F10 P00742 1/20 0.37
FAAH O00519 1/20 0.36
NAAA Q02083 1/20 0.36
RBP4 P02753 5/20 0.36
VNN1 O95497 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
MGLL Q99685 1/20 0.34
HDAC4 P56524 1/20 0.34
ACACB O00763 2/20 0.34
ACACA Q13085 2/20 0.34
SLC9A1 P19634 1/20 0.34
NPY5R Q15761 1/20 0.34
CHRM1 P11229 1/20 0.33
ENPP2 Q13822 1/20 0.33

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
SCHEMBL3053749 0.93 F10 (0.36) SCD5USP2F10RBP4VNN1
SCHEMBL3071150 0.93 F10 (0.36) SCD5USP2F10RBP4VNN1
SCHEMBL3071106 0.93 HSD11B1 (0.39) F10RBP4VNN1TRPV1NPY5R
SCHEMBL3058415 0.92 PIK3CA (0.36) SCD5USP2F10FAAHNAAA
SCHEMBL3057911 0.92 NPY5R (0.40) SCD5USP2F10RBP4VNN1
SCHEMBL3068347 0.91 PIK3CA (0.37) SCD5USP2F10RBP4VNN1
SCHEMBL3066363 0.90 RBP4 (0.36) SCD5USP2F10RBP4VNN1
SCHEMBL3072450 0.90 ALDH1A1 (0.42) F10RBP4VNN1TRPV1ACACB
SCHEMBL3057907 0.90 F10 (0.36) SCD5USP2F10RBP4VNN1
SCHEMBL3066293 0.89 NPC1 (0.37) F10RBP4MGLL

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 SCD5 3866/4885USP2 3640/4885F10 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.