SCHEMBL13624403

SCHEMBL13624403

CCOC(=O)CC1CCN(CC)C(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
BRD4 O60885 1/20 0.40
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 4/20 0.38
FKBP1A P62942 2/20 0.38
FKBP4 Q02790 1/20 0.38
FKBP5 Q13451 1/20 0.38
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.35
PARP14 Q460N5 1/20 0.35
CYP2D6 P10635 1/20 0.35
MIF P14174 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL13624405 0.81 POLB (0.40) POLBBRD4ALDH1A1MAPT
SCHEMBL13652365 0.78 MEN1 (0.37) POLBBRD4KMT2AALDH1A1FKBP1A
SCHEMBL13624406 0.78 GAA (0.38) BRD4KMT2AALDH1A1
SCHEMBL21945155 0.76 USP19 (0.36) BRD4
SCHEMBL13624400 0.73 PIK3CD (0.32) BRD4ALOX15
SCHEMBL27313851 0.73 KMT2A (0.40) POLBBRD4KMT2AALDH1A1MAPT
SCHEMBL10767654 0.73 BRD4 (0.49) POLBBRD4KMT2AALDH1A1FKBP1A
SCHEMBL2607204 0.73 NCF1 (0.41) POLBKMT2AALDH1A1MAPTPARP14
SCHEMBL18595476 0.73 POLB (0.40) POLBKMT2AALDH1A1MAPTPARP14
SCHEMBL1717843 0.72 POLB (0.38) POLBKMT2AALDH1A1FKBP1AMAPT

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
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed