SCHEMBL11051571

SCHEMBL11051571

CCc1c(C)c(O)[nH]c(=O)c1C#N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UPP1 Q16831 5/20 0.56
KDM4E B2RXH2 9/20 0.44
ALDH1A1 P00352 7/20 0.44
HPGD P15428 6/20 0.44
HSD17B10 Q99714 3/20 0.44
ALOX15 P16050 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
CYP2C19 P33261 3/20 0.43
CYP1A2 P05177 2/20 0.43
ATM Q13315 2/20 0.42
KMT2A Q03164 3/20 0.41
GLA P06280 1/20 0.40
CYP2C9 P11712 1/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
USP2 O75604 1/20 0.39
RAB9A P51151 1/20 0.39
MCL1 Q07820 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL11121714 0.86 UPP1 (0.69) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL26354493 0.86 UPP1 (0.51) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL29771552 0.82 UPP1 (0.52) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6543058 0.81 UPP1 (0.51) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL8901518 0.80 UPP1 (0.61) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6625526 0.77 UPP1 (0.66) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5182348 0.76 UPP1 (0.64) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL3794931 0.75 KDM4E (0.64) UPP1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6655303 0.75 UPP1 (0.68) UPP1KDM4EALDH1A1HPGDAPOBEC3G
SCHEMBL8941878 0.73 UPP1 (0.61) UPP1KDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0159962-A2 Fibre-reactive chromium or cobalt complexes, their preparation and their use CIBA-GEIGY AG (CH) 1985-10-30 EP disclosed
EP-0142104-A2 Fibre-reactive chromium complexes, their preparation and their use CIBA-GEIGY AG (CH) 1985-05-22 EP disclosed
EP-0037377-A1 Metal-complex dyestuffs, their preparation and use CIBA-GEIGY AG (CH) 1981-10-07 EP disclosed
EP-0009466-A1 1 : 2-Bis-chromium-complex dyestuffs from polyazo- or disazo-azomethine compounds, their preparation and their use CIBA-GEIGY AG (CH) 1980-04-02 EP disclosed
EP-0005207-A2 Bis-1:2 chrome-disazo-bisazo methine dyestuffs, their preparation and use for dyeing of leather CIBA-GEIGY AG (CH) 1979-11-14 EP disclosed