SCHEMBL8942682

SCHEMBL8942682

CC(CN(O)C(=O)c1cccc(Oc2ccccc2)c1)NC(N)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
ALOX5 P09917 4/20 0.50
HTR1D P28221 1/20 0.46
HTR1B P28222 1/20 0.46
AKR1C3 P42330 1/20 0.46
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
PTGES O14684 1/20 0.45
TNKS O95271 1/20 0.43
PARP15 Q460N3 1/20 0.43
PARP14 Q460N5 1/20 0.43
PARP10 Q53GL7 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
PARP2 Q9UGN5 1/20 0.43
ACACA Q13085 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41

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
SCHEMBL8782837 0.84 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1LMNAALOX5HTR1D
SCHEMBL8782847 0.84 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1LMNAALOX5HTR1D
SCHEMBL8782561 0.81 ALOX5 (0.48) SMN1; SMN2ALDH1A1LMNAALOX5HTR1D
SCHEMBL8942794 0.77 ALOX5 (0.53) SMN1; SMN2ALDH1A1LMNAALOX5HTR1D
SCHEMBL8783536 0.75 KDM4E (0.57) SMN1; SMN2ALDH1A1LMNAALOX5HTR1D
SCHEMBL8783528 0.75 KDM4E (0.57) SMN1; SMN2ALDH1A1LMNAALOX5HTR1D
SCHEMBL8942402 0.74 EPOR (0.46) LMNAALOX5AKR1C3ERCC5FEN1
SCHEMBL8942426 0.74 PPARG (0.44) ALDH1A1LMNAALOX5PTGESACACA
SCHEMBL8782273 0.73 ACACB (0.45) PTGESACACA
SCHEMBL9876838 0.72 AKR1C3 (0.64) SMN1; SMN2ALDH1A1LMNAALOX5AKR1C3

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-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed