SCHEMBL8996630

SCHEMBL8996630

CCC(C)C1CCC2(CC1)OCC(CCl)O2

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
GAA P10253 1/20 0.31

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
SCHEMBL9003781 0.90 PABPC1 (0.32) PABPC1CTDSP1
SCHEMBL9520955 0.78
SCHEMBL13823649 0.77 ADRA1A (0.32) PABPC1CTDSP1
SCHEMBL9426366 0.77 GAA (0.53) PABPC1CTDSP1GAA
SCHEMBL24079288 0.77
SCHEMBL8996692 0.76 GAA (0.39) GAA
SCHEMBL8798930 0.74 PABPC1 (0.36) PABPC1CTDSP1GAA
SCHEMBL6580763 0.74 PABPC1 (0.50) PABPC1CTDSP1GAA
SCHEMBL6217663 0.74 PABPC1 (0.50) PABPC1CTDSP1GAA
SCHEMBL9426648 0.73 GAA (0.42) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571930-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-11-05 US disclosed
US-5493034-A Intermediate for pesticidal aminomethylheterocyclic compounds BAYER AKTIENGESELLSCHAFT (DE) 1996-02-20 US disclosed
US-5447927-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1995-09-05 US disclosed
US-5376660-A An aminomethyl-1,4-dioxaspiro(4,5)decanes pesticides or fungicides BAYER AKTIENGESELLSCHAFT (DE) 1994-12-27 US disclosed
US-5177103-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1993-01-05 US disclosed
EP-0359979-B1 AMINOMETHYLHETEROCYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, THEIR USE IN PESTICIDES, AND INTERMEDIATES BAYER AG (DE) 1992-12-30 EP disclosed
US-5010101-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1991-04-23 US disclosed
EP-0359979-A1 Aminomethylheterocyclic compounds, process for their preparation, their use in pesticides, and intermediates BAYER AG (DE) 1990-03-28 EP disclosed