SCHEMBL14488697

SCHEMBL14488697

CC(C)N1CNCC(=O)C1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.35
TOP2B Q02880 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PTGS1 P23219 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.31
THRB P10828 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL14499442 0.70
SCHEMBL17898508 0.69 ALDH1A1 (0.37) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL10092705 0.68
SCHEMBL15764826 0.68
SCHEMBL10360616 0.67 TOP2A (0.31) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL20864922 0.67
SCHEMBL11670185 0.65
SCHEMBL1698568 0.64
SCHEMBL1698543 0.62 ALDH1A1 (0.39) TOP2ATOP2BALDH1A1MAPTTDP1
Isopropylamine SCHEMBL28267226 0.62

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
US-7235549-B2 Benzamide, heteroarylamide and reverse amides PFIZER INC. (US) 2007-06-26 US disclosed
US-7214677-B2 Benzamide, heteroarylamide and reverse amides PFIZER INC. (US) 2007-05-08 US disclosed