SCHEMBL7575941

SCHEMBL7575941

CCCOC(=O)C(=O)C(Cl)C(=O)OCCC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HCAR2 Q8TDS4 1/20 0.35
ALDH1A1 P00352 3/20 0.34
TSHR P16473 3/20 0.33
LMNA P02545 1/20 0.33
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
THRB P10828 1/20 0.31

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
SCHEMBL9513788 0.88 ALDH1A1 (0.47) SMN1; SMN2HCAR2ALDH1A1TSHRLMNA
SCHEMBL9516135 0.86 TSHR (0.50) HCAR2ALDH1A1TSHRLMNA
SCHEMBL9513561 0.85 TSHR (0.53) HCAR2ALDH1A1TSHRLMNA
SCHEMBL28581100 0.84 HCAR2 (0.41) GAASMN1; SMN2HCAR2ALDH1A1TSHR
SCHEMBL1445319 0.78 ALDH1A1 (0.40) GAASMN1; SMN2ALDH1A1TSHRLMNA
SCHEMBL26068495 0.78 ALDH1A1 (0.38) GAASMN1; SMN2HCAR2ALDH1A1TSHR
SCHEMBL7585457 0.75 HCAR2 (0.35) GAASMN1; SMN2HCAR2ALDH1A1TSHR
SCHEMBL9513524 0.75 HCAR2 (0.35) GAASMN1; SMN2HCAR2ALDH1A1TSHR
SCHEMBL28712042 0.75 HCAR2 (0.35) GAASMN1; SMN2HCAR2ALDH1A1TSHR
SCHEMBL9720649 0.75 HCAR2 (0.41) GAASMN1; SMN2HCAR2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588372-B1 Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL IND CO LTD (JP) 2002-10-02 EP disclosed
EP-0357792-B1 PROCESS FOR PREPARING PYRIDINE-2,3-DICARBOXYLIC ACID COMPOUNDS SUGAI CHEMICAL IND CO LTD (JP) 1995-06-28 EP disclosed
EP-0588372-A1 Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 1994-03-23 EP disclosed
US-5252739-A Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL IND. CO., LTD. (JP) 1993-10-12 US disclosed
EP-0274379-B1 PROCESS FOR PREPARING PYRIDINE-2,3-DICARBOXYLIC ACID COMPOUNDS SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 1993-06-30 EP disclosed
US-5175300-A Reacting a halo-oxalactic ester with 2-propenal and ammonia; cyclization SUGAI CHEMICAL IND. CO., LTD. (JP) 1992-12-29 US disclosed
EP-0220518-B1 PREPARATION OF SUBSTITUTED AND DISUBSTITUTED PYRIDINE-2,3-DICARBOXYLATE ESTERS AMERICAN CYANAMID COMPANY (US) 1991-02-06 EP disclosed
US-4973695-A FROM UNSATURATED ALDEHYDE OR KETONE WITH OXODIESTER SUGAI CHEMICAL IND. CO., LTD. (JP) 1990-11-27 US disclosed
EP-0357792-A1 PROCESS FOR PREPARING PYRIDINE-2,3-DICARBOXYLIC ACID COMPOUNDS SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-03-14 EP disclosed
EP-0274379-A2 Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-07-13 EP disclosed
US-4723011-A ALPHA-HALO-BETA-KETOESTERS, ALPHA, BETA UNSATURATED KETONE OR ALDEHYDE, AMMONIUM SALT AMERICAN CYANAMID COMPANY (US) 1988-02-02 US disclosed
EP-0220518-A2 Preparation of substituted and disubstituted pyridine-2,3-dicarboxylate esters AMERICAN CYANAMID COMPANY (US) 1987-05-06 EP disclosed