SCHEMBL7325813

SCHEMBL7325813

CC(C)Oc1ccc(C(N)=O)cc1OC(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.59
IRAK4 Q9NWZ3 2/20 0.51
MAPK1 P28482 2/20 0.50
TOP2A P11388 2/20 0.49
PDE4B Q07343 2/20 0.48
POLB P06746 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
PDE4A P27815 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
PDK1 Q15118 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL4277719 0.93 MAPK1 (0.59) PARP10IRAK4MAPK1TOP2APDE4B
SCHEMBL15521569 0.92 PARP10 (0.51) PARP10IRAK4MAPK1TOP2APDE4B
SCHEMBL24812339 0.91 MAPK1 (0.62) PARP10MAPK1PDE4BPOLBCYP1A2
SCHEMBL2411718 0.86 PARP10 (0.56) PARP10IRAK4MAPK1TOP2APDE4B
SCHEMBL6112896 0.86 PARP10 (0.56) PARP10IRAK4MAPK1TOP2APOLB
SCHEMBL16605596 0.86 PARP10 (0.56) PARP10IRAK4MAPK1TOP2APDE4B
SCHEMBL23606802 0.86 PARP10 (0.56) PARP10IRAK4MAPK1TOP2APDE4B
SCHEMBL30739434 0.86 IRAK4 (0.62) PARP10IRAK4MAPK1TOP2APDE4B
Acetic Acid Methyl Ester SCHEMBL29204546 0.85 MAPK1 (0.46) PARP10IRAK4MAPK1TOP2APDE4B
SCHEMBL11364482 0.85 ALDH1A1 (0.61) PARP10IRAK4MAPK1TOP2APDE4B

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
CN-101166712-B Hydroxamic acid derivatives and the preparation method thereof AMOREPACIFIC CORP 2011-08-03 CN claimed
CN-101166712-A Hydroxamic acid derivatives and the preparation method thereof AMOREPACIFIC CORP (KR) 2008-04-23 CN claimed
CN-101166712-B Hydroxamic acid derivatives and the preparation method thereof AMOREPACIFIC CORP 2011-08-03 CN disclosed
CN-101166712-A Hydroxamic acid derivatives and the preparation method thereof AMOREPACIFIC CORP (KR) 2008-04-23 CN disclosed
EP-0852142-A1 Diamines in the treatment of arrhythmia SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) 1998-07-08 EP disclosed
EP-0639973-A1 DIAMINES IN THE TREATMENT OF ARRHYTHMIA SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) 1995-03-01 EP disclosed
WO-1993023024-A1 DIAMINES IN THE TREATMENT OF ARRHYTHMIA SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) 1993-11-25 WO disclosed