SCHEMBL5725988

SCHEMBL5725988

CNC1CCCc2on(COC(=O)C(C)(C)C)c(=O)c21

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ENO1 P06733 1/20 0.31
ACHE P22303 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
SCHEMBL5725991 1.00 ENO1 (0.31) ENO1ACHE
SCHEMBL7978989 0.89 POLB (0.38) ENO1ACHE
SCHEMBL5725518 0.70 ENO1 (0.31) ENO1
SCHEMBL5725261 0.64 SMN1; SMN2 (0.41)
SCHEMBL5725264 0.64 SMN1; SMN2 (0.41)
SCHEMBL29362852 0.63 POLB (0.38) ENO1
SCHEMBL9839151 0.59 PDE4A (0.38) ENO1
SCHEMBL28106918 0.55 ENO1 (0.36) ENO1
SCHEMBL5725154 0.55 LMNA (0.34)
SCHEMBL5725158 0.55 LMNA (0.34)

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-0812318-B1 4-AMINOTETRAHYDROBENZISOXAZOLE OR -ISOTHIAZOLE COMPOUNDS LUNDBECK & CO AS H (DK) 2006-02-08 EP disclosed
US-5998613-A PSYCHOLOGICAL DISORDERS; ANALGESICS; ANTICONVULSANTS H. LUNDBECK A/S (DK) 1999-12-07 US disclosed