SCHEMBL20095673

SCHEMBL20095673

CN(C)[C@@H]1CC[C@@H]2C[C@@H]2C1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 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
SCHEMBL20095683 1.00 TDP1 (0.31) TDP1
SCHEMBL20096001 0.92 TDP1 (0.32) TDP1
SCHEMBL9359755 0.84 ALDH1A1 (0.40)
SCHEMBL21316451 0.84 ALDH1A1 (0.33)
SCHEMBL12133506 0.78 TDP1 (0.38) TDP1
SCHEMBL14755102 0.75 NR1H2 (0.31)
SCHEMBL25589748 0.75
SCHEMBL19968074 0.74 HTR2A (0.35) TDP1
SCHEMBL661220 0.71 TDP1 (0.42) TDP1
SCHEMBL613375 0.71

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-2018072602-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-26 WO disclosed