SCHEMBL25262256

SCHEMBL25262256

CN1CCCCC1CO.CN1CCCC[C@H]1CO

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADRA2A P08913 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
SCHEMBL2421142 1.00
SCHEMBL4680796 1.00
SCHEMBL283488 1.00
Hydrochloric Acid SCHEMBL11468862 0.98 CYP1A2 (0.53) CYP1A2POLBL3MBTL1ADRA2A
SCHEMBL7279980 0.98 CYP1A2 (0.59) CYP1A2POLBL3MBTL1ADRA2A
SCHEMBL84792 0.93
SCHEMBL1086946 0.93
SCHEMBL26011205 0.93
SCHEMBL30917693 0.93
SCHEMBL178545 0.93

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-4208485-A1 PROCESS AND CATALYSTS FOR HYDROGEN MEDIATED ANIONIC POLYMERIZATION OF CONJUGATED DIENES AND LIQUID POLYMERS THEREOF ALBEMARLE CORPORATION (US) 2023-07-12 EP disclosed