SCHEMBL28206702

SCHEMBL28206702

O=C(Nc1ccc(Br)cc1)OC1CC1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.60
BCL2 P10415 1/20 0.52
KMT2A Q03164 4/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
EPHX2 P34913 1/20 0.50
MEN1 O00255 3/20 0.49
EPHX1 P07099 1/20 0.49
BCHE P06276 2/20 0.48
ACHE P22303 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
SCHEMBL1171515 0.92 RAB9A (0.56) CHRNA7KMT2ANPC1RAB9AMEN1
SCHEMBL11888862 0.85 SMN1; SMN2 (0.51) CHRNA7KMT2ANPC1RAB9AMEN1
SCHEMBL27544341 0.81 BCHE (0.66) CHRNA7KMT2ANPC1RAB9AMEN1
SCHEMBL935633 0.78 CHRNA7 (0.55) CHRNA7KMT2ANPC1RAB9AMEN1
SCHEMBL12166518 0.76 FAAH (0.57) KMT2ANPC1RAB9AMEN1EPHX1
SCHEMBL12407207 0.76 NPC1 (0.54) KMT2ANPC1RAB9AMEN1EPHX1
SCHEMBL21059186 0.76 NPC1 (0.58) KMT2ANPC1RAB9AMEN1EPHX1
SCHEMBL12407158 0.76 NPC1 (0.58) KMT2ANPC1RAB9AMEN1EPHX1
SCHEMBL373044 0.76 CHRNA7 (1.00) CHRNA7NPC1RAB9ABCHEACHE
SCHEMBL5809206 0.75 FAAH (0.73) CHRNA7KMT2ANPC1RAB9AMEN1

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-107872976-A Method for treatment albumen matter disease 建新公司 2018-04-03 CN disclosed