SCHEMBL8611277

SCHEMBL8611277

C=CCOCC(=O)OC.C=COCC(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.34
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
TRPA1 O75762 1/20 0.32
NLRP3 Q96P20 3/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL1471358 0.85 TDP1 (0.51) TDP1MGAMGAASIMGAM2
SCHEMBL7772546 0.82
SCHEMBL7770911 0.82
SCHEMBL7774733 0.78
SCHEMBL25756076 0.76 TDP1 (0.54) TDP1MGAMGAASIMGAM2
SCHEMBL29192929 0.74 GAA (0.54) MGAMGAASIMGAM2TSHR
SCHEMBL3204338 0.74 TDP1 (0.44) TDP1MGAMGAASIMGAM2
SCHEMBL13008143 0.73 TDP1 (0.50) TDP1MGAMGAASIMGAM2
SCHEMBL5873282 0.72 TDP1 (0.61) TDP1GAASMN1; SMN2TSHRALDH1A1
SCHEMBL12050320 0.72 TDP1 (0.49) TDP1MGAMGAASIMGAM2

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
US-5773508-A BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-06-30 US disclosed