SCHEMBL8595606

SCHEMBL8595606

COCn1c(C(F)(F)F)nc2c(C(=O)Nc3c(Cl)cccc3Cl)cccc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.46
PDE4A P27815 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
PTGES O14684 6/20 0.44
LCK P06239 1/20 0.39
PDE11A Q9HCR9 1/20 0.39
PIK3C2B O00750 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL8602720 0.85 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DPTGES
SCHEMBL8598543 0.85 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DPTGES
SCHEMBL8598985 0.84 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DPTGES
SCHEMBL8601221 0.84 HPGD (0.46) PDE4BPDE4APDE4CPDE4DPTGES
SCHEMBL8600336 0.84 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DPTGES
SCHEMBL8602102 0.83 TYK2 (0.44) PDE4BPDE4APDE4CPDE4DLCK
SCHEMBL8598600 0.82 THRB (0.42) PDE4BPDE4APDE4CPDE4DPTGES
SCHEMBL8597372 0.82 PTGES (0.45) PTGESMEN1KMT2APOLB
SCHEMBL8562791 0.81 PIK3C2B (0.41) PIK3C2BMAPT
SCHEMBL8600059 0.80 PTGES (0.40) PDE4BPDE4APDE4CPDE4DPTGES

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0863881-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-16 EP disclosed
WO-1997010219-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-20 WO disclosed