SCHEMBL11355035

SCHEMBL11355035

CN1CCC2c3[nH]c4ccccc4c3CCN2C1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.62
▸ ADRA1A P35348 4/20 0.59
▸ ADRA1D P25100 3/20 0.59
▸ ADRA1B P35368 3/20 0.59
▸ ADRA2A P08913 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ DRD2 P14416 2/20 0.47
▸ DRD1 P21728 2/20 0.47
▸ DRD5 P21918 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ CYP2D6 P10635 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ GMNN O75496 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ DRD4 P21917 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ DRD3 P35462 1/20 0.47
▸ MTOR P42345 1/20 0.47

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
SCHEMBL11352715 0.81 MAPKAPK2 (0.55) ADRA1AADRA1DKDM4EDRD2DRD1
SCHEMBL30363084 0.81 CHRNA7 (0.67) CHRNA7ADRA1AADRA1DADRA1BKDM4E
SCHEMBL2887057 0.81 CHRNA7 (0.67) CHRNA7ADRA1AADRA1DADRA1BKDM4E
SCHEMBL30363160 0.81 CHRNA7 (0.67) CHRNA7ADRA1AADRA1DADRA1BKDM4E
Desbromoarborescidine A SCHEMBL31662855 0.80 CHRNA7 (0.66) CHRNA7ADRA1AADRA1DADRA1BADRA2A
Desbromoarborescidine A SCHEMBL30363173 0.80 CHRNA7 (0.66) CHRNA7ADRA1AADRA1DADRA1BADRA2A
Desbromoarborescidine A SCHEMBL29002756 0.80 CHRNA7 (0.66) CHRNA7ADRA1AADRA1DADRA1BADRA2A
Desbromoarborescidine A SCHEMBL5269957 0.80 CHRNA7 (0.66) CHRNA7ADRA1AADRA1DADRA1BADRA2A
SCHEMBL11352593 0.79 ADRA1D (0.53) CHRNA7ADRA1AADRA1DADRA1BKDM4E
SCHEMBL29458059 0.78 CHRNA7 (0.64) CHRNA7ADRA1AADRA1DADRA1BADRA2A

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
US-4277476-A ANTI-ANOXIA AND PSYCHOTROPIC AGENTS SYNTHELABO (FR) 1981-07-07 — — US disclosed
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