SCHEMBL27622745

SCHEMBL27622745

CCCC(=O)ON1CCC(c2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC18A3 Q16572 6/20 0.60
▸ DRD2 P14416 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.48
▸ KCNH2 Q12809 1/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.44
▸ NAMPT P43490 1/20 0.44
▸ HTR7 P34969 3/20 0.43
▸ PRCP P42785 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ OPRM1 P35372 1/20 0.43

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
SCHEMBL27604008 0.80 SLC18A3 (0.58) SLC18A3DRD2SIGMAR1KCNH2HRH3
SCHEMBL27488566 0.78 RIPK1 (0.51) SLC18A3DRD2SIGMAR1KCNH2HRH3
SCHEMBL4198757 0.78 NAMPT (0.65) SLC18A3DRD2SIGMAR1KCNH2HRH3
SCHEMBL16393857 0.77 SLC18A3 (0.48) SLC18A3DRD2SIGMAR1KCNH2HRH3
SCHEMBL6245254 0.77 NAMPT (0.64) SLC18A3DRD2SIGMAR1KCNH2HRH3
SCHEMBL4976350 0.77 SLC18A3 (0.60) SLC18A3DRD2SIGMAR1ALDH1A1KDM4E
SCHEMBL29111290 0.76 SLC18A3 (0.57) SLC18A3SIGMAR1KCNH2HRH3ALDH1A1
SCHEMBL7380238 0.75 ALDH1A1 (0.38) SLC18A3ALDH1A1KDM4ELMNAGAA
SCHEMBL8528754 0.75 SLC18A3 (0.46) SLC18A3SIGMAR1KCNH2HRH3
Hydrochloric Acid SCHEMBL27976831 0.75 AKR1C3 (0.46) SLC18A3SIGMAR1KCNH2HRH3ALDH1A1

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
CN-1649840-A Non-peptidic BRS-3 agonists SOLVAY PHARM GMBH (DE) 2005-08-03 — — CN disclosed
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