SCHEMBL24153446

SCHEMBL24153446

CN1CC(=O)N2CCN(Cc3ccc4ccccc4n3)CC2C1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 2/20 0.43
▸ DRD4 P21917 1/20 0.42
▸ HCRTR1 O43613 8/20 0.41
▸ HCRTR2 O43614 8/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ OPRL1 P41146 1/20 0.41
▸ OPRM1 P35372 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ PDE2A O00408 1/20 0.39
▸ MCHR1 Q99705 1/20 0.39
▸ BCHE P06276 1/20 0.38
▸ ACHE P22303 1/20 0.38

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
SCHEMBL26092261 0.80 KMT2A (0.41) FAAHDRD4HTR1AACHE
SCHEMBL30337587 0.80 FAAH (0.44) FAAH
SCHEMBL30337242 0.79 HTR1A (0.44) FAAHDRD4HCRTR1HCRTR2HTR1A
SCHEMBL24145684 0.79 FAAH (0.39) FAAHDRD4HCRTR1HCRTR2HTR1A
SCHEMBL30337200 0.79 FAAH (0.39) FAAHDRD4HCRTR1HCRTR2HTR1A
SCHEMBL23334537 0.76 BCHE (0.44) DRD4HCRTR1HCRTR2HTR1AHTR7
SCHEMBL24938938 0.73 CYP19A1 (0.38) FAAHDRD4HTR1A
SCHEMBL1331198 0.72 FAAH (0.65) FAAHDRD4HTR1AHTR7OPRL1
SCHEMBL17289123 0.72 FAAH (0.65) FAAHDRD4HTR1AHTR7OPRL1
SCHEMBL1331611 0.71 FAAH (0.58) FAAHHTR1AHTR7MCHR1

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
WO-2021261969-A1 PREPARATION METHOD FOR NOVEL COMPOUND 홀로스메딕 주식회사 2021-12-30 — — WO disclosed
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