SCHEMBL8560889

SCHEMBL8560889

CC[C@H]1CN(N)C[C@H]1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.33
HRH3 Q9Y5N1 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
SCHEMBL8563800 1.00 NR1H2 (0.33) NR1H2HRH3
SCHEMBL8698693 1.00 NR1H2 (0.33) NR1H2HRH3
SCHEMBL8560594 0.88 ALDH1A1 (0.33) NR1H2
SCHEMBL8557989 0.85 GNAI3 (0.31) NR1H2
SCHEMBL8558324 0.83 ALOX5 (0.37)
SCHEMBL8562259 0.81 CTSK (0.31)
SCHEMBL8558285 0.81
SCHEMBL8560496 0.80 MAPK1 (0.36) NR1H2HRH3
SCHEMBL7502439 0.80 MAPK1 (0.36) NR1H2HRH3
SCHEMBL8564185 0.80 MAPK1 (0.36) NR1H2HRH3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5837868-A REACTION OF DIHYDROXY OLEFINS IN A MULTISTAGE PROCESS ARYL METHYLAMINE TO FORM PYRROLIDINE INTERMEDIATE ABBOTT LABORATORIES (US) 1998-11-17 US disclosed
US-5703244-A CYCLIZATION OF DIHYDROXY OLEFINS WITH TARTRATE ESTER IN PRESENCE OF TITANIUM ISOPROPOXIDE AND TERT-BUTYL HYDROPEROXIDE ABBOTT LABORATORIES (US) 1997-12-30 US disclosed