SCHEMBL7500559

SCHEMBL7500559

CC(C)N(C=O)C1CCC(N(C)C(N)=S)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 2/20 0.53
ADH1A P07327 2/20 0.53
ADH1B P00325 1/20 0.53
FAAH O00519 1/20 0.30
PHGDH O43175 1/20 0.30
MGLL Q99685 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
SCHEMBL7498978 0.79 ADH1C (0.56) ADH1CADH1AADH1B
SCHEMBL27605000 0.78
SCHEMBL5127609 0.74 ADH1B (0.46) ADH1CADH1AADH1B
SCHEMBL7471560 0.72 ADH1B (0.47) ADH1CADH1AADH1B
SCHEMBL9462559 0.72 ADH1A (0.95) ADH1CADH1AADH1B
SCHEMBL5123903 0.70 ADH1C (0.58) ADH1CADH1AADH1B
SCHEMBL4274516 0.70 FAAH (0.38) FAAHPHGDHMGLL
SCHEMBL4274519 0.70 FAAH (0.38) FAAHPHGDHMGLL
SCHEMBL9463243 0.70 ADH1A (1.00) ADH1CADH1AADH1B
Hydrochloric Acid SCHEMBL5128398 0.69 ADH1B (0.56) ADH1CADH1AADH1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183245-A4 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMA CORP (US) 2002-10-02 EP disclosed
EP-1183245-A1 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2002-03-06 EP disclosed
WO-2000064880-A1 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-11-02 WO disclosed