SCHEMBL12075232

SCHEMBL12075232

CC1CCC(C2(C)CCC(C3CCC(N)CC3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 1/20 0.30
CDK5R1 Q15078 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
SCHEMBL8041346 0.81 CDK5 (0.40) CDK5CDK5R1
SCHEMBL8482546 0.79 CDK5 (0.33) CDK5CDK5R1
SCHEMBL8482544 0.79 CDK5 (0.33) CDK5CDK5R1
SCHEMBL883405 0.78
SCHEMBL17690783 0.78
SCHEMBL16248242 0.78
SCHEMBL17693864 0.78
SCHEMBL5968011 0.78
SCHEMBL19336919 0.76 CDK5 (0.32) CDK5CDK5R1
SCHEMBL19336912 0.76 CDK5 (0.32) CDK5CDK5R1

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
EP-2208774-B1 Liquid crystalline medium MERCK PATENT GMBH (DE) 2012-08-29 EP disclosed
EP-1724324-B1 Liquid crystalline medium MERCK PATENT GMBH (DE) 2009-07-22 EP disclosed