SCHEMBL7967647

SCHEMBL7967647

CCOC(=O)C(O)COC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
LMNA P02545 2/20 0.56
HSD17B10 Q99714 1/20 0.56
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
USP2 O75604 3/20 0.35
CYP3A4 P08684 3/20 0.35
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RECQL P46063 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HIF1A Q16665 1/20 0.35
TRPA1 O75762 1/20 0.34

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
SCHEMBL18914211 0.79 TDP1 (0.42) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL29115594 0.79 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRALOX15
SCHEMBL21101392 0.79 TDP1 (0.42) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL18913867 0.79 TDP1 (0.42) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL1784947 0.79 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL30231620 0.79 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRALOX15
SCHEMBL29115592 0.79 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRALOX15
SCHEMBL1784949 0.79 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL16491484 0.78 TDP1 (0.45) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL12017716 0.77 ALDH1A1 (0.56) ALDH1A1LMNAHSD17B10TSHRTDP1

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-6215016-B1 HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA TORAY INDUSTRIES, INC. (JP) 2001-04-10 US disclosed
EP-0841063-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1998-05-13 EP disclosed