SCHEMBL38095

SCHEMBL38095

CC1CCN(c2cc[c]cn2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.35
PIK3CD O00329 1/20 0.33
RXRA P19793 3/20 0.31
RXRB P28702 3/20 0.31
RXRG P48443 3/20 0.31

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
SCHEMBL38109 0.83
SCHEMBL15553072 0.76 CRBN (0.49)
SCHEMBL46307 0.75 GPR119 (0.41) IDH1RXRARXRBRXRG
SCHEMBL16498267 0.74 GRIN2D (0.38) IDH1
SCHEMBL6599307 0.74 KDM4E (0.33)
SCHEMBL8194170 0.73 MAPT (0.48)
SCHEMBL37681 0.71 CNR2 (0.43) IDH1
SCHEMBL8235167 0.71 TDO2 (0.40) IDH1
SCHEMBL15416403 0.71 IDH1 (0.36) IDH1PIK3CD
SCHEMBL16699036 0.70 DDB1 (0.36) IDH1PIK3CD

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-2011151436-A2 NOVEL COMPOUNDS, METHOD FOR USE THEM AND PHARMACEUTICAL COMPOSITION CONTAINING THEM EUROSCREEN S.A. (BE) 2011-12-08 WO disclosed