SCHEMBL5382485

SCHEMBL5382485

CN(C)S(=O)(=O)NCC1CCC(CNC(N)=S)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
NPY5R Q15761 4/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 2/20 0.34
GBA1 P04062 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.30
ACACB O00763 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
SCHEMBL5387500 0.86 NPY5R (0.42) TDP1NPY5RKMT2AMEN1POLB
SCHEMBL5387497 0.86 NPY5R (0.42) TDP1NPY5RKMT2AMEN1POLB
SCHEMBL3918722 0.84 ALDH1A1 (0.45) NPY5RKMT2AMEN1POLBALDH1A1
SCHEMBL7470115 0.83 NPY5R (0.34) TDP1NPY5RKMT2AMEN1POLB
SCHEMBL5382919 0.80 ALDH1A1 (0.38) TDP1NPY5RKMT2AMEN1POLB
SCHEMBL5131843 0.80 ALDH1A1 (0.38) TDP1NPY5RKMT2AMEN1POLB
SCHEMBL1960773 0.78
SCHEMBL5382478 0.78 TDP1 (0.38) TDP1
SCHEMBL5392388 0.73 ALDH1A1 (0.51) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL12313412 0.72 NPY5R (0.41) NPY5RKMT2AMEN1POLBALDH1A1

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-7273880-B2 Selective NPY (Y5) antagonists H. LUNBECK A/S (DK) 2007-09-25 US disclosed
EP-1194421-B1 SELECTIVE NPY (Y5) ANTAGONISTS LUNDBECK & CO AS H (DK) 2005-10-12 EP disclosed
US-20050137240-A1 Selective NPY (Y5) antagonists H. LUNDBECK A/S (DK) 2005-06-23 US disclosed
US-6222040-B1 FOR THERAPY OF EATING DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-04-24 US 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-20050137240-A1 Selective NPY (Y5) antagonists NPY5R, NPY1R, NPY2R TDP1 3169/4885NPY5R 1/4885KMT2A 3383/4885

“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.