SCHEMBL7683343

SCHEMBL7683343

COCc1c(Cl)ccc(C)c1NC(=O)c1ccc(C)nc1C(=O)NC(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.39
PDE4D Q08499 6/20 0.39
PDE4A P27815 5/20 0.39
PDE4C Q08493 5/20 0.39
P2RX7 Q99572 1/20 0.34
PTGER4 P35408 1/20 0.33
PTGES O14684 1/20 0.33
SORT1 Q99523 1/20 0.33
S1PR4 O95977 1/20 0.33
PTGS2 P35354 1/20 0.32
GFER P55789 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 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
SCHEMBL7682738 0.92 ALDH1A1 (0.37) PDE4BPDE4DPDE4APDE4CP2RX7
SCHEMBL7677539 0.89 HPGD (0.39) PDE4BPDE4DPDE4APDE4CP2RX7
SCHEMBL7678830 0.88 PDE4A (0.33) PDE4BPDE4DPDE4APDE4CPTGER4
SCHEMBL7679361 0.86 PDE4B (0.38) PDE4BPDE4DPDE4APDE4CPTGES
SCHEMBL7681363 0.84 PTGS2 (0.41) PDE4BPDE4DPDE4APDE4CS1PR4
SCHEMBL7677645 0.84 PTGS2 (0.40) PDE4BPDE4DPDE4APDE4CPTGS2
SCHEMBL7677655 0.84 CNR2 (0.40) PDE4BPDE4DPDE4APDE4CP2RX7
SCHEMBL7684085 0.83 PDE4D (0.40) PDE4BPDE4DPDE4APDE4CPTGER4
SCHEMBL7677560 0.81 GRM5 (0.35) PDE4BPDE4DPDE4APDE4CL3MBTL1
SCHEMBL7682639 0.77 ALDH1A1 (0.38) PDE4BPDE4DPDE4APDE4CSORT1

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