SCHEMBL11529203

SCHEMBL11529203

NC[C@@H]1CCCC[C@H]1N1CCCC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.61
▸ CYP2D6 P10635 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL12714714 1.00 TDP1 (0.61) TDP1CYP2D6MEN1KMT2ALMNA
SCHEMBL11529209 1.00 TDP1 (0.61) TDP1CYP2D6MEN1KMT2ALMNA
SCHEMBL15769635 0.98 TDP1 (0.64) TDP1
SCHEMBL15783533 0.98 TDP1 (0.64) TDP1
SCHEMBL15783527 0.98 TDP1 (0.64) TDP1
SCHEMBL6393609 0.98 TDP1 (0.64) TDP1
SCHEMBL15783526 0.98 TDP1 (0.64) TDP1
Hydrochloric Acid SCHEMBL16143332 0.96 TDP1 (0.62) TDP1
SCHEMBL12714711 0.95 TDP1 (0.55) TDP1CYP2D6MEN1KMT2ALMNA
SCHEMBL12714722 0.93 TDP1 (0.53) TDP1CYP2D6MEN1KMT2A

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
US-4145435-A 2-AMINOCYCLOALIPHATIC AMIDE COMPOUNDS THE UPJOHN COMPANY (US) 1979-03-20 — — US disclosed
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