SCHEMBL7679448

SCHEMBL7679448

CCc1ccc(Br)c(C(=O)OC)c1NC(=O)c1ccc(C)nc1C(=O)NC(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 2/20 0.33
F2 P00734 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 5/20 0.32
HSD17B10 Q99714 3/20 0.32
HPGD P15428 3/20 0.32
KDM4E B2RXH2 3/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
TSHR P16473 1/20 0.32
CASP1 P29466 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RAB9A P51151 3/20 0.32
NPC1 O15118 2/20 0.32
ALOX12 P18054 1/20 0.32
MEN1 O00255 2/20 0.32

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
SCHEMBL7684669 0.93 MAPT (0.34) SMN1; SMN2KMT2AMAPTF2ALDH1A1
SCHEMBL7685879 0.89 MAPT (0.34) KMT2AMAPTF2LMNAALDH1A1
SCHEMBL7675233 0.87 ALDH1A1 (0.34) SMN1; SMN2KMT2AMAPTF2LMNA
SCHEMBL7678756 0.85 HTT (0.38) SMN1; SMN2MAPTLMNAALDH1A1HSD17B10
SCHEMBL7684146 0.84 MAPT (0.35) SMN1; SMN2KMT2AMAPTF2ALDH1A1
SCHEMBL7679296 0.84 CNR1 (0.38) KMT2AMEN1CNR2
SCHEMBL7679315 0.84 ALDH1A1 (0.35) SMN1; SMN2KMT2AMAPTF2LMNA
SCHEMBL7685899 0.82 ALDH1A1 (0.37) SMN1; SMN2KMT2AMAPTALDH1A1HPGD
SCHEMBL7685639 0.79 ALDH1A1 (0.36) SMN1; SMN2KMT2AMAPTF2LMNA
SCHEMBL7679294 0.78 ALDH1A1 (0.34) SMN1; SMN2KMT2AMAPTF2LMNA

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-6472349-B1 Pyridine-2,3-dicarboxylic acid diamides BASF AKTIENGESELLSCHAFT (DE) 2002-10-29 US claimed