SCHEMBL7464374

SCHEMBL7464374

COC(=O)c1cccc(-n2c(=O)c(Cc3nc[nH]n3)nc3cccnc32)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
RXFP1 Q9HBX9 2/20 0.44
PDE4B Q07343 2/20 0.44
PDE4D Q08499 2/20 0.44
PDE4A P27815 1/20 0.44
PDE4C Q08493 1/20 0.44
TP53 P04637 4/20 0.44
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.43
STAT3 P40763 1/20 0.43
ALOX15 P16050 2/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL6799395 0.86 PDE4A (0.50) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6799259 0.85 ALDH1A1 (0.50) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6803285 0.84 TP53 (0.47) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6796416 0.84 ALDH1A1 (0.46) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6796816 0.80 ALDH1A1 (0.54) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6804709 0.79 RXFP1 (0.48) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6793249 0.79 GRM5 (0.44) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6797576 0.79 HPGD (0.44) ALDH1A1HPGDL3MBTL1RXFP1PDE4B
SCHEMBL6797485 0.78 GAA (0.43) ALDH1A1PDE4BPDE4DPDE4APDE4C
SCHEMBL6799545 0.77 ALOX15 (0.58) ALDH1A1HPGDRXFP1PDE4BPDE4D

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-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed