SCHEMBL6635518

SCHEMBL6635518

O=C(NC1CC2CCN(C2)C1)c1ccc(Cl)c(O)n1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 7/20 0.59
CNR1 P21554 3/20 0.39
PRKAA2 P54646 2/20 0.36
HSD11B1 P28845 1/20 0.36
HTR7 P34969 2/20 0.36
USP30 Q70CQ3 3/20 0.36
GRM5 P41594 1/20 0.36

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
SCHEMBL6098659 1.00 CHRNA7 (0.59) CHRNA7CNR1PRKAA2HSD11B1HTR7
SCHEMBL6098653 1.00 CHRNA7 (0.59) CHRNA7CNR1PRKAA2HSD11B1HTR7
SCHEMBL6099675 0.94 CHRNA7 (0.51) CHRNA7CNR1PRKAA2HSD11B1HTR7
SCHEMBL6101050 0.87 CHRNA7 (0.58) CHRNA7CNR1PRKAA2HSD11B1HTR7
SCHEMBL6101043 0.87 CHRNA7 (0.58) CHRNA7CNR1PRKAA2HSD11B1HTR7
SCHEMBL6100767 0.86 CHRNA7 (0.59) CHRNA7CNR1PRKAA2HSD11B1GRM5
SCHEMBL6100771 0.86 CHRNA7 (0.59) CHRNA7CNR1PRKAA2HSD11B1GRM5
SCHEMBL6631465 0.86 CHRNA7 (0.59) CHRNA7CNR1PRKAA2HSD11B1GRM5
SCHEMBL6632916 0.84 CHRNA7 (0.55) CHRNA7CNR1PRKAA2USP30
SCHEMBL6100212 0.84 CHRNA7 (0.55) CHRNA7CNR1PRKAA2USP30

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-1478646-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
WO-2003072578-A1 AZABICYCLIC COMPOUNDS WITH ALFA7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO disclosed