SCHEMBL7635599

SCHEMBL7635599

COC(=O)C(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
EGFR P00533 3/20 0.50
ERBB2 P04626 3/20 0.50
POLB P06746 1/20 0.50
CNR2 P34972 2/20 0.49
KMT2A Q03164 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 2/20 0.46
CTBP2 P56545 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
SCHEMBL10732366 0.90 HTT (0.48) ALDH1A1POLBL3MBTL1NPC1LMNA
SCHEMBL15956194 0.87 ALDH1A1 (0.53) ALDH1A1EGFRERBB2POLBCNR2
SCHEMBL7641899 0.82 ALDH1A1 (0.51) ALDH1A1KMT2ANPC1RAB9AMEN1
SCHEMBL7642353 0.82 EGFR (0.49) ALDH1A1EGFRERBB2KMT2AL3MBTL1
SCHEMBL8870180 0.82 FNTA (0.57) ALDH1A1NPC1RAB9ALMNAMAPT
SCHEMBL5808567 0.81 MAPT (0.52) ALDH1A1POLBKMT2AL3MBTL1NPC1
SCHEMBL7635524 0.81 CNR2 (0.47) ALDH1A1CNR2KMT2AL3MBTL1NPC1
SCHEMBL7060526 0.81 PLAAT3 (0.61) ALDH1A1POLBKMT2AMEN1
SCHEMBL7697179 0.81 ALDH1A1 (0.54) ALDH1A1EGFRERBB2POLBCNR2
SCHEMBL7642020 0.81 HTT (0.65) ALDH1A1EGFRPOLBNPC1RAB9A

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-4390702-A 3-Substituted-3-fluoropyruvic acids and their esters and salts, and production thereof DAIKAN KOGYO CO., LTD. (JP) 1983-06-28 US claimed
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
EP-0153692-B1 METHOD FOR ISOMERIZATION A GLYCIDATE DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP disclosed
US-4621150-A METAL PERHALATE OR SULFONATE OR COMPLEX; GLYCIDATE, 2-HYDROXY-3-BUTENOATE, EPOXIDE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-11-04 US disclosed
EP-0189272-A2 New furanone derivatives, processes for preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-07-30 EP disclosed
EP-0153692-A2 Method for isomerization a glycidate derivative SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-09-04 EP disclosed
EP-0031982-B1 3-SUBSTITUTED-3-FLUOROPYRUVIC ACIDS AND THEIR ESTERS AND SALTS, AND PRODUCTION THEREOF Daikin Kogyo Co., Ltd. (JP) 1985-06-05 EP disclosed
US-4390702-A 3-Substituted-3-fluoropyruvic acids and their esters and salts, and production thereof DAIKAN KOGYO CO., LTD. (JP) 1983-06-28 US disclosed
EP-0031982-A2 3-Substituted-3-fluoropyruvic acids and their esters and salts, and production thereof Daikin Kogyo Co., Ltd. (JP) 1981-07-15 EP disclosed