SCHEMBL14848973

SCHEMBL14848973

CNC(=O)c1cc(C(C)=O)cc(C(=O)Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HPGD P15428 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HDAC2 Q92769 1/20 0.41
CA5A P35218 1/20 0.40
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PLK1 P53350 5/20 0.37
PLAU P00749 1/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
CA2 P00918 1/20 0.35
LMNA P02545 1/20 0.34
MMP13 P45452 1/20 0.34
PRKCI P41743 1/20 0.34
BRD4 O60885 1/20 0.34

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
SCHEMBL19988556 0.89 HDAC8 (0.52) HDAC8HDAC6HPGDALDH1A1HDAC2
SCHEMBL16350551 0.89 HDAC8 (0.52) HDAC8HDAC6HPGDALDH1A1HDAC2
SCHEMBL10041772 0.85 CA5A (0.52) HPGDALDH1A1CA5ATSHRHTT
SCHEMBL4623865 0.85 CA5A (0.52) HPGDALDH1A1CA5ATSHRHTT
SCHEMBL4478521 0.80 HDAC8 (0.60) HDAC8HDAC6HPGDALDH1A1HDAC2
SCHEMBL14067800 0.78 KMT2A (0.48) ALDH1A1CA5ALMNAPRKCI
SCHEMBL20404600 0.77 HDAC8 (0.42) HDAC8HDAC6HPGDALDH1A1HDAC2
Acetone SCHEMBL28498158 0.75 LMNA (0.38) HDAC8HPGDALDH1A1CA5ATSHR
SCHEMBL15545731 0.74 HDAC8 (0.64) HDAC8HDAC6HPGDALDH1A1HDAC2
SCHEMBL3786661 0.74 HDAC8 (0.50) HDAC8HDAC6HPGDALDH1A1HDAC2

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-20130089727-A1 Thin film composites NILSEN, TOM NILS (NO) 2013-04-11 US disclosed