SCHEMBL2345864

SCHEMBL2345864

C=C(C)C(=O)Nc1ccc(C(=O)O)c(O)c1.[NaH]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
PKM P14618 1/20 0.55
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 2/20 0.48
RXFP1 Q9HBX9 1/20 0.47
PYGL P06737 2/20 0.46
EPHX2 P34913 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 4/20 0.45
HSD17B10 Q99714 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TSHR P16473 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44

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
SCHEMBL344699 0.98 KMT2A (0.56) KMT2APKMTDP1SMN1; SMN2POLB
SCHEMBL31280644 0.98 KMT2A (0.56) KMT2APKMTDP1SMN1; SMN2POLB
SCHEMBL2345867 0.97 KMT2A (0.55) KMT2APKMTDP1SMN1; SMN2POLB
Acrylic Acid SCHEMBL4529072 0.88 KMT2A (0.47) KMT2APKMTDP1SMN1; SMN2POLB
SCHEMBL346822 0.86 MAPT (0.56) KMT2APKMTDP1POLBRXFP1
SCHEMBL29381797 0.86 MAPT (0.56) KMT2APKMTDP1POLBRXFP1
SCHEMBL3632249 0.85 TDP1 (0.54) KMT2APKMTDP1POLBRXFP1
SCHEMBL30772316 0.85 KMT2A (0.67) KMT2APKMTDP1SMN1; SMN2POLB
SCHEMBL27296224 0.85 KMT2A (0.67) KMT2APKMTDP1SMN1; SMN2POLB
SCHEMBL11804736 0.83 SMN1; SMN2 (0.68) KMT2APKMTDP1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008430-B2 High molecular weight polymers containing pendant salicylic acid groups for clarifying bayer process liquors NALCO COMPANY (US) 2011-08-30 US disclosed
US-7560032-B2 High molecular weight polymers containing pendant salicylic acid groups for clarifying Bayer process liquors NALCO COMPANY (US) 2009-07-14 US disclosed
EP-1597301-B1 HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS NALCO CO (US) 2008-04-09 EP disclosed
US-20060276597-A1 High molecular weight polymers containing pendant salicylic acid groups for clarifying bayer process liquors ECOLAB USA INC. 2006-12-07 US disclosed
US-20060273040-A1 High molecular weight polymers containing pendant salicylic acid groups for clarifying Bayer process liquors ECOLAB USA INC. 2006-12-07 US disclosed
US-7138472-B2 High molecular weight polymers containing pendant salicylic acid groups for clarifying bayer process liquors NALCO COMPANY (US) 2006-11-21 US disclosed
EP-1597301-A4 HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS NALCO CO (US) 2006-05-17 EP disclosed
EP-1597301-A2 HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS Nalco Company (US) 2005-11-23 EP disclosed
WO-2004076510-A2 HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS NALCO COMPANY (US) 2004-09-10 WO disclosed
US-20040024156-A1 High molecular weight polymers containing pendant salicylic acid groups for clarifying bayer process liquors ECOLAB USA INC. 2004-02-05 US disclosed