SCHEMBL7640286

SCHEMBL7640286

CCOC(=O)C(CCCCCC(C)C)C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 4/20 0.40
MAPT P10636 2/20 0.40
CPB2 Q96IY4 2/20 0.40
FAAH O00519 1/20 0.39
MAPK1 P28482 2/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4C Q9H3R0 2/20 0.37
KDM4A O75164 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 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
SCHEMBL7634946 0.98 TDP1 (0.42) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL8460623 0.94 TDP1 (0.42) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL482827 0.92 TDP1 (0.46) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL19861335 0.90 TDP1 (0.49) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL486944 0.87 FAAH (0.47) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL1393537 0.87 FAAH (0.47) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL6309982 0.87 FAAH (0.47) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL873537 0.87 FAAH (0.47) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL1393272 0.87 FAAH (0.47) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL4904972 0.87 FAAH (0.47) TDP1MEN1KMT2AL3MBTL1MAPT

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
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP disclosed