SCHEMBL10486753

SCHEMBL10486753

CC(CN1CC(C)(C)NC(C)(C)C1=O)NC1CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL31745564 0.84 ALDH1A1 (0.31) ALDH1A1
SCHEMBL10664933 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL10486756 0.76 RAD52 (0.39) ALDH1A1
SCHEMBL10486749 0.76 RAD52 (0.39) ALDH1A1
SCHEMBL9326448 0.76 RAD52 (0.39) ALDH1A1
SCHEMBL9718232 0.76 IDH1 (0.30)
SCHEMBL9351938 0.74 KDM4E (0.40) ALDH1A1
SCHEMBL6167979 0.73 MEN1 (0.36)
SCHEMBL11096985 0.72 PDE4A (0.33)
SCHEMBL11096636 0.71 PDE4A (0.31)

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-4841053-A Process for desensitizing a 1-(alkylamino)alkyl-polysubstituted piperazinone during recovery THE B. F. GOODRICH COMPANY (US) 1989-06-20 US disclosed