SCHEMBL11115020

SCHEMBL11115020

CC(N)C1(CC2OCCO2)CC2CCC1C2

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 1/20 0.31
SLC47A1 Q96FL8 1/20 0.31
MAPT P10636 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
SCHEMBL10850143 0.70
SCHEMBL13034810 0.68 ALOX5AP (0.33)
SCHEMBL13034822 0.68 ALOX5AP (0.33)
SCHEMBL11115022 0.68 GRIN2D (0.32)
SCHEMBL10849044 0.66 HSD11B1 (0.33)
SCHEMBL18220553 0.64 ALOX5AP (0.30)
SCHEMBL19459385 0.61
SCHEMBL29359899 0.58 GRIN2D (0.39) SLC22A2SLC47A1MAPT
SCHEMBL13779596 0.58
SCHEMBL13779594 0.58

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
EP-0116276-A2 Derivatives of spirocyclic amino-acids, their process of preparation, agents containing them, and their use, as well as spirocyclic amino-acids as intermediaries and their process of preparation HOECHST AKTIENGESELLSCHAFT (DE) 1984-08-22 EP disclosed