SCHEMBL10696372

SCHEMBL10696372

CCOC(=O)C(=O)C(Cl)(CC)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
TSHR P16473 1/20 0.38
EGLN1 Q9GZT9 1/20 0.37
NPSR1 Q6W5P4 1/20 0.35
GLO1 Q04760 1/20 0.35
CYP2D6 P10635 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
CYP2C9 P11712 1/20 0.33
SOAT1 P35610 1/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL20503396 0.79 CYP4F2 (0.40) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL11201754 0.76 ALDH1A1 (0.45) ALDH1A1TSHREGLN1NPSR1GLO1
SCHEMBL6678513 0.75 TSHR (0.44) ALDH1A1TSHRCYP2D6MEN1KMT2A
SCHEMBL7069570 0.72 EGLN1 (0.37) ALDH1A1TSHREGLN1NPSR1GLO1
SCHEMBL27350419 0.72 CYP4F2 (0.38) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL9719100 0.72 CYP4F2 (0.44) ALDH1A1TSHRLMNAHSD17B10MEN1
SCHEMBL27486109 0.72 CYP4F2 (0.44) ALDH1A1TSHREGLN1NPSR1GLO1
Ammonia Solution, Strong SCHEMBL27650220 0.70 CYP4F2 (0.42) ALDH1A1TSHREGLN1NPSR1GLO1
SCHEMBL289488 0.69 ALDH1A1 (0.38) ALDH1A1TSHRMEN1KMT2A
SCHEMBL3853357 0.69 ALDH1A1 (0.46) ALDH1A1TSHREGLN1NPSR1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274379-A2 Process for preparing pyridine-2,3-dicarboxylic acid compounds SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-07-13 EP disclosed