SCHEMBL6152410

SCHEMBL6152410

O=C(CCCCCNc1ccccc1C(=O)O)OO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
HSD17B10 Q99714 4/20 0.59
HPGD P15428 4/20 0.59
KDM4E B2RXH2 5/20 0.47
AGTR1 P30556 1/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.44
POLB P06746 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
KDM6B O15054 2/20 0.44
KDM4C Q9H3R0 2/20 0.44
PLK1 P53350 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RECQL P46063 1/20 0.43
GLA P06280 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
NCOR2 Q9Y618 1/20 0.42

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
SCHEMBL5518973 0.85 ALDH1A1 (0.76) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5514066 0.85 ALDH1A1 (0.76) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5510920 0.83 ALDH1A1 (0.78) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL309080 0.80 ALDH1A1 (0.53) ALDH1A1KMT2AHDAC3HDAC1HDAC2
SCHEMBL721515 0.80 ALDH1A1 (0.53) ALDH1A1KMT2AHDAC3HDAC1HDAC2
SCHEMBL3475665 0.79 PLK1 (0.66) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL11430175 0.79 PLK1 (0.66) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5272720 0.79 PLK1 (0.66) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL5694119 0.79 PLK1 (0.66) ALDH1A1HSD17B10HPGDKDM4EAGTR1
SCHEMBL11437269 0.79 PLK1 (0.66) ALDH1A1HSD17B10HPGDKDM4EAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846757-B1 Machine dishwashing gel composition UNILEVER NV (NL) 2005-01-26 EP disclosed
EP-0816481-B1 Peracid granules containing citric acid monohydrate for improved dissolution rates UNILEVER NV (NL) 2004-09-15 EP disclosed
EP-0883670-B1 MACHINE DISHWASHING GEL COMPOSITIONS UNILEVER NV (NL) 2001-11-07 EP disclosed
US-5858945-A AUTOMATIC DISHWASHER LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1999-01-12 US disclosed
EP-0846757-A2 Machine dishwashing gel composition UNILEVER N.V. (NL) 1998-06-10 EP disclosed
EP-0835925-A2 Machine dishwashing composition containing amphoteric polymers UNILEVER N.V. (NL) 1998-04-15 EP disclosed
US-5731277-A Automatic dishwashing compositions containing aluminum tetrahydroxide LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1998-03-24 US disclosed
EP-0816481-A2 Peracid granules containing citric acid monohydrate for improved dissolution rates UNILEVER N.V. (NL) 1998-01-07 EP disclosed