SCHEMBL2318241

SCHEMBL2318241

CCCS(=O)(=O)N1CCC(CC(=O)Nc2ccc(-c3cc(F)cc(F)c3)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 13/20 0.48
DEGS1 O15121 2/20 0.48
USP30 Q70CQ3 1/20 0.46
ABL1 P00519 1/20 0.44
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RORC P51449 1/20 0.41

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
SCHEMBL2318660 0.89 NPY5R (0.52) NPY5RDEGS1USP30ABL1
SCHEMBL2318008 0.83 RAB9A (0.51) DEGS1USP30LMNASMN1; SMN2
SCHEMBL2417326 0.83 EPHX2 (0.44) NPY5RDEGS1USP30LMNASMN1; SMN2
SCHEMBL2320672 0.82 WNT3A (0.53) NPY5RDEGS1USP30ABL1
SCHEMBL2319049 0.75 EPHX2 (0.47) USP30LMNASMN1; SMN2
SCHEMBL2321999 0.74 USP30 (0.50) DEGS1USP30ABL1SMN1; SMN2
SCHEMBL12284422 0.74 NPY5R (0.60) NPY5RDEGS1USP30ABL1
SCHEMBL13362183 0.74 NPY5R (0.60) NPY5RDEGS1USP30ABL1
SCHEMBL2417021 0.73 NPY5R (0.49) NPY5RDEGS1USP30ABL1
SCHEMBL2417423 0.73 NPY5R (0.49) NPY5RDEGS1USP30ABL1

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-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
US-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
US-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
EP-2352730-A2 BIOLOGICALLY ACTIVE AMIDES H. Lundbeck A/S (DK) 2011-08-10 EP disclosed
WO-2010053861-A2 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2010-05-14 WO disclosed
WO-2010053861-A2 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2010-05-14 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-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES NPY5R, NPY1R, NPY2R NPY5R 1/4885DEGS1 3961/4885USP30 3697/4885

“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.