Ciaftalan

Ciaftalan

SCHEMBL8965441

CCCCCCCCOC[Mn-](COCCCCCCCC)(COCCCCCCCC)(COCCCCCCCC)(COCCCCCCCC)(COCCCCCCCC)(COCCCCCCCC)COCCCCCCCC.c1ccc2c(c1)-c1nc-2nc2[nH]c(nc3nc(nc4[nH]c(n1)c1ccccc41)-c1ccccc1-3)c1ccccc21

nearest known ligand 0.37

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.37
PDE4A P27815 2/20 0.37
PDE4B Q07343 2/20 0.37
PDE4C Q08493 2/20 0.37
PDE4D Q08499 2/20 0.37
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ELANE P08246 2/20 0.32
TLR8 Q9NR97 1/20 0.32
CCNB2 O95067 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
Ciaftalan SCHEMBL5973010 0.91 PDE5A (0.40) PDE5APDE4APDE4BPDE4CPDE4D
Ciaftalan SCHEMBL11520284 0.84 MEN1 (0.39) KDM4ELMNAHTTSMN1; SMN2CYP1A2
Ciaftalan SCHEMBL11414517 0.81 PDE5A (0.39) PDE5APDE4APDE4BPDE4CPDE4D
Ciaftalan SCHEMBL9075585 0.79 ELANE (0.36) PDE5APDE4APDE4BPDE4CPDE4D
Ciaftalan SCHEMBL7950273 0.79 HPGD (0.39) PDE5ALMNAALDH1A1TSHRHSD17B10
Ciaftalan SCHEMBL9471480 0.79 ELANE (0.33) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL5707000 0.79 PDE5A (0.45) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL28034499 0.79 PDE5A (0.46) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL28035087 0.79 PDE5A (0.46) PDE5APDE4APDE4BPDE4CPDE4D
Ciaftalan SCHEMBL29211555 0.78 TLR8 (0.44) ALDH1A1TSHRELANETLR8

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
EP-0549068-B1 Alkyl peroxides and uses DSM NV (NL) 1996-02-21 EP disclosed