SCHEMBL907554

SCHEMBL907554

CCC[C@H]1CCCC(C)(C)[C@@H]1C

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42

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
SCHEMBL6517249 1.00 CA1 (0.42) CA1CA2CA4
SCHEMBL6517246 1.00 CA1 (0.42) CA1CA2CA4
SCHEMBL6517247 1.00 CA1 (0.42) CA1CA2CA4
SCHEMBL672248 0.78 ALDH1A1 (0.31)
SCHEMBL14099603 0.72 NOS1 (0.32) CA1CA2CA4
SCHEMBL11591596 0.69 CA1 (0.67) CA1CA2CA4
SCHEMBL17063633 0.69 CA1 (0.59) CA1CA2CA4
SCHEMBL18813658 0.69 L3MBTL1 (0.31)
SCHEMBL3439389 0.67 CA1 (0.32) CA1CA2CA4
SCHEMBL3439393 0.67 CA1 (0.32) CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1682109-B1 THE USE OF 1-AMINOCYCLOHEXANE DERIVATIVES TO MODIFY DEPOSITION OF FIBRILLOGENIC AS PEPTIDES IN AMYLOIDOPATHIES MERZ PHARMA GMBH & CO KGAA (DE) 2008-10-15 EP claimed
US-6602862-B1 1-Amino-alkylcyclohexanes as trypanocidal agents MERZ PHARMA GMBH & CO., KGAA (DE) 2003-08-05 US claimed
EP-2277850-A1 1-amino-alkylcyclohexanes as 5-HT3 and neuronal nicotinic receptor antagonists Merz Pharma GmbH & Co. KGaA (DE) 2011-01-26 EP disclosed
EP-1318800-B1 1-AMINO-ALKYLCYCLOHEXANES AS TRYPANOCIDAL AGENTS MERZ PHARMA GMBH & CO KGAA (DE) 2005-01-26 EP disclosed
US-6602862-B1 1-Amino-alkylcyclohexanes as trypanocidal agents MERZ PHARMA GMBH & CO., KGAA (DE) 2003-08-05 US disclosed
EP-1303477-A2 1-AMINO-ALKYLCYCLOHEXANES AS 5-HT3- AND NEURONAL NICOTINICRECEPTOR ANTAGONISTS MERZ + CO. GmbH & Co. (DE) 2003-04-23 EP disclosed
WO-2001098253-A2 1-AMINO-ALKYLCYCLOHEXANES AS 5-HT3 AND NEURONAL NICOTINICRECEPTOR ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2001-12-27 WO disclosed