SCHEMBL25214463

SCHEMBL25214463

CCCCOC(=O)N1CCC2(CC1)CC(Oc1ccc(Cl)nn1)C2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 2/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MGLL Q99685 2/20 0.36
▸ SMYD3 Q9H7B4 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ HRH2 P25021 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ ITGB3 P05106 2/20 0.35
▸ ITGA2B P08514 2/20 0.35
▸ GPR119 Q8TDV5 7/20 0.35
▸ LOXL2 Q9Y4K0 1/20 0.34
▸ ENPP2 Q13822 1/20 0.34
▸ ATXN2 Q99700 1/20 0.34

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
SCHEMBL20920037 0.81 GPR119 (0.49) POLBGPR119
SCHEMBL20919473 0.81 MGLL (0.36) LMNASMN1; SMN2MGLLITGB3ITGA2B
SCHEMBL30186325 0.74 GPR119 (0.33) POLBSMN1; SMN2GPR119
SCHEMBL30225407 0.73 SMN1; SMN2 (0.54) OPRD1OPRK1LMNAPOLBSMN1; SMN2
SCHEMBL21384398 0.72 SMN1; SMN2 (0.52) OPRD1OPRK1LMNAPOLBSMN1; SMN2
SCHEMBL30177238 0.72 SMN1; SMN2 (0.52) OPRD1OPRK1LMNAPOLBSMN1; SMN2
SCHEMBL30002152 0.70 SMN1; SMN2 (0.50) OPRD1OPRK1LMNAPOLBSMN1; SMN2
SCHEMBL30135739 0.70 LMNA (0.50) OPRD1OPRK1LMNAPOLBSMN1; SMN2
SCHEMBL29502235 0.69 LMNA (0.49) OPRD1OPRK1LMNAPOLBSMN1; SMN2
SCHEMBL30177286 0.69 SMN1; SMN2 (0.49) OPRD1OPRK1LMNAPOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3697781-B1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNIV VANDERBILT (US) 2023-06-07 — — EP disclosed
Send feedback