SCHEMBL18780883

SCHEMBL18780883

CC1(COc2cc(N)[nH]n2)CC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.32
APP P05067 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL18780938 0.72 GAA (0.41)
SCHEMBL16290898 0.71 FFAR2 (0.35) FFAR2APPBACE1
SCHEMBL1493347 0.70 PIK3CA (0.36)
SCHEMBL20024105 0.70 HPGD (0.32) FFAR2
SCHEMBL20024034 0.65
SCHEMBL20023949 0.64 HPGD (0.36)
SCHEMBL2564347 0.62 TDP1 (0.52) APP
SCHEMBL24798149 0.61 NUDT1 (0.42)
SCHEMBL23671166 0.61 NUDT1 (0.42)
SCHEMBL21273840 0.61 DGAT1 (0.40)

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-2017069270-A1 NITROGEN-CONTAINING CONDENSED HETEROCYCLIC COMPOUND 大正製薬株式会社 2017-04-27 WO disclosed