SCHEMBL7839416

SCHEMBL7839416

CC(C)(C)OC(=O)C12CCC(CN1)C2

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSC P53634 2/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 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
SCHEMBL4190764 0.73 GRM4 (0.32) CTSCMEN1KMT2A
SCHEMBL21013695 0.73 GRM4 (0.32) CTSCMEN1KMT2A
SCHEMBL4186248 0.73 GRM4 (0.32) CTSCMEN1KMT2A
SCHEMBL16064984 0.73 GRM4 (0.32) CTSCMEN1KMT2A
SCHEMBL901346 0.73 GRM4 (0.32) CTSCMEN1KMT2A
SCHEMBL16064857 0.73 GRM4 (0.32) CTSCMEN1KMT2A
SCHEMBL20586469 0.73 DDB1 (0.33)
SCHEMBL15532995 0.71
SCHEMBL216423 0.70 ALDH1A1 (0.43) MEN1MAPK1KMT2A
SCHEMBL4877040 0.70 NPSR1 (0.33) CTSC

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-0663912-B1 HETEROCYCLIC ETHER COMPOUNDS THAT ENHANCE COGNITIVE FUNCTION ABBOTT LAB (US) 2001-12-12 EP disclosed