SCHEMBL6057412

SCHEMBL6057412

COC(=O)[C@H]1CNCC[C@@H]1Cc1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.44

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
SCHEMBL7448822 1.00 SSTR4 (0.44) SSTR4
SCHEMBL4661812 0.88 ALDH1A1 (0.41)
SCHEMBL4661814 0.88 ALDH1A1 (0.41)
SCHEMBL2636787 0.87 ALDH1A1 (0.42) SSTR4
SCHEMBL7441689 0.87 ALDH1A1 (0.42) SSTR4
Hydrochloric Acid SCHEMBL7800914 0.85 ALDH1A1 (0.41) SSTR4
SCHEMBL7809845 0.84 NPC1 (0.34)
SCHEMBL7812352 0.84 MEN1 (0.36)
SCHEMBL7800948 0.84 KCNH2 (0.43)
SCHEMBL7806075 0.83 HRH1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1680113-A2 DOPAMINE-, NOREPINEPHRINE- AND SEROTONIN- TRANSPORTER- SELECTIVE HETEROCYCLIC COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS GEORGETOWN UNIVERSITY (US) 2006-07-19 EP disclosed
WO-2005041875-A2 DOPAMINE-, NOREPINEPHRINE- AND SEROTONIN- TRANSPORTER- SELECTIVE HETEROCYCLIC COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS GEORGETOWN UNIVERSITY (US) 2005-05-12 WO disclosed