SCHEMBL6233663

SCHEMBL6233663

Cc1ccccc1C1(N)CCCCC1N

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.41

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
SCHEMBL23595664 0.83 HDAC4 (0.41) HDAC4
SCHEMBL23595680 0.83 HDAC4 (0.41) HDAC4
SCHEMBL8777356 0.75 OPRL1 (0.44)
SCHEMBL28794925 0.72 MAOB (0.47)
SCHEMBL5224741 0.71 HDAC4 (0.47) HDAC4
SCHEMBL11971962 0.69 HDAC4 (0.44) HDAC4
SCHEMBL27403689 0.68 ABCC1 (0.32)
SCHEMBL4775447 0.68 HTR2A (0.38)
SCHEMBL16031140 0.68 HDAC4 (0.41) HDAC4
SCHEMBL24462785 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1854128-B Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds MASSACHUSETTS INST TECHNOLOGY 2012-05-16 CN claimed
CN-1854128-B Copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds MASSACHUSETTS INST TECHNOLOGY 2012-05-16 CN disclosed
EP-1519912-A2 PROCESS FOR INCREASING THE SELECTIVITY OF THE HYDROGENATION OF 4,4'-DIAMINODIPHENYLMETHANE TO 4,4'-DIAMINODICYCLOHEXYLMETHANE IN THE PRESENCE OF AN N-ALKYL-4,4'-DIAMINODIPHENYLMETHANE Degussa AG (DE) 2005-04-06 EP disclosed
WO-2004007425-A2 PROCESS FOR INCREASING THE SELECTIVITY OF THE HYDROGENATION OF 4,4'-DIAMINODIPHENYLMETHANE TO 4,4'-DIAMINODICYCLOHEXYLMETHANE IN THE PRESENCE OF AN N-ALKYL-4,4'-DIAMINODIPHENYLMETHANE DEGUSSA AG (DE) 2004-01-22 WO disclosed