SCHEMBL14364159

SCHEMBL14364159

CC1OCC2c3[nH]c4ccccc4c3CCN12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.55
▸ ADRA1A P35348 3/20 0.52
▸ ADRA1D P25100 2/20 0.52
▸ ADRA1B P35368 2/20 0.52
▸ POLB P06746 1/20 0.50
▸ LMNA P02545 1/20 0.45
▸ CYP2D6 P10635 4/20 0.44
▸ CYP1A2 P05177 2/20 0.43
▸ CASP1 P29466 2/20 0.43
▸ CASP7 P55210 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ BCHE P06276 1/20 0.42
▸ PDE5A O76074 2/20 0.42
▸ PRKCB P05771 1/20 0.42
▸ CYP1A1 P04798 1/20 0.42
▸ CYP1B1 Q16678 1/20 0.42
▸ MEN1 O00255 2/20 0.42

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
SCHEMBL14363779 0.84 KIF11 (0.46) MEN1KMT2A
SCHEMBL14364171 0.84 CHRNA7 (0.49) CHRNA7ADRA1AADRA1DADRA1BPOLB
SCHEMBL14364157 0.84 CHRNA7 (0.49) CHRNA7ADRA1AADRA1DADRA1BPOLB
SCHEMBL14364155 0.82 ADRA1D (0.50) CHRNA7ADRA1AADRA1DADRA1BPOLB
SCHEMBL14363770 0.81 MAPT (0.54) ADRA1AADRA1DCYP2D6CYP1A2HSD17B10
SCHEMBL14363773 0.78 ABCG2 (0.52) ADRA1ALMNAPDE5AMEN1KMT2A
SCHEMBL3867321 0.76 CHRNA7 (0.58) CHRNA7ADRA1AADRA1DADRA1BPOLB
SCHEMBL21648535 0.73 CHRNA7 (0.42) CHRNA7ADRA1AADRA1DADRA1BPOLB
SCHEMBL21648518 0.73 CHRNA7 (0.42) CHRNA7ADRA1AADRA1DADRA1BPOLB
SCHEMBL21648536 0.73 CHRNA7 (0.42) CHRNA7ADRA1AADRA1DADRA1BPOLB

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-2007147819-A1 3H,11H-OXAZOLO[3',4':1,2]PYRIDO[3,4-B]INDOLE DERIVATIVES AND THERAPEUTIC USE THEREOF FOURTILLAN (FR) 2007-12-27 — — WO disclosed
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