SCHEMBL10448332

SCHEMBL10448332

CCOP(=O)(CC)OCSC(CO)COC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
PPARD Q03181 1/20 0.35
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.30

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
SCHEMBL9675367 0.85 PPARD (0.37) TSHRPPARDALDH1A1LMNAHSD17B10
SCHEMBL10448349 0.85 TSHR (0.56) TSHRPPARD
SCHEMBL9685475 0.72 PPARD (0.46) TSHRPPARDALDH1A1LMNAHSD17B10
SCHEMBL9793358 0.71 TSHR (0.46) TSHRPPARDALDH1A1LMNAHSD17B10
Acetic Acid SCHEMBL28974626 0.68 TSHR (0.75) TSHRPPARDALDH1A1LMNAHSD17B10
SCHEMBL9675540 0.68 PPARD (0.47) TSHRPPARDMAPT
SCHEMBL28821812 0.67 TSHR (0.65) TSHRPPARDALDH1A1LMNAHSD17B10
SCHEMBL10439318 0.67 TSHR (0.41) TSHRPPARDALDH1A1LMNAHSD17B10
SCHEMBL4971866 0.66 TSHR (0.71) TSHRPPARD
SCHEMBL10485634 0.66 TSHR (0.58) TSHRPPARDLMNAMAPT

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-0399743-A1 Phosphonomethylthio-alkoseypureine derivatives, intermediate products for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-11-28 EP disclosed