SCHEMBL17524640

SCHEMBL17524640

C[C@H](CCN1CCOCC1(C)C)[C@@H](O)CC(N)=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL17087400 0.78 KDM4E (0.46) KDM4E
SCHEMBL27619692 0.76 KDM4E (0.38) GRM2KDM4E
SCHEMBL4546608 0.74
SCHEMBL17518320 0.74 KDM4E (0.41) KDM4E
SCHEMBL17518390 0.73 GAA (0.48) KDM4E
SCHEMBL17518316 0.73 KMT2A (0.35) KDM4E
SCHEMBL17518331 0.72 GAA (0.47) KDM4E
SCHEMBL17518386 0.72 GRM2 (0.32) GRM2KDM4E
SCHEMBL17518397 0.72 GRM2 (0.32) GRM2KDM4E
SCHEMBL17087393 0.72 GRM2 (0.32) GRM2KDM4E

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-9266927-B2 Cyclosporin A analogs ALLERGAN, INC. (US) 2016-02-23 US disclosed