SCHEMBL9857513

SCHEMBL9857513

CCOP(=O)(COCC(CON)COC(C)=O)OCC

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
TSHR P16473 2/20 0.32
PPARD Q03181 1/20 0.32

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
SCHEMBL10447621 0.85 TSHR (0.40) ALDH1A1LMNAHSD17B10TSHR
SCHEMBL10448229 0.82 PPARD (0.38) ALDH1A1LMNAHSD17B10TSHRPPARD
SCHEMBL9685456 0.81 PPARD (0.40) ALDH1A1LMNAHSD17B10MAPTMAPK1
SCHEMBL10439318 0.78 TSHR (0.41) ALDH1A1LMNAHSD17B10TSHRPPARD
SCHEMBL9857508 0.75 POLB (0.38) ALDH1A1MAPTMAPK1
SCHEMBL8839568 0.72 PPARD (0.46) ALDH1A1LMNAHSD17B10MAPTMAPK1
SCHEMBL12903591 0.72 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10MAPTMAPK1
SCHEMBL8764430 0.72 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10MAPTMAPK1
SCHEMBL8401424 0.72 ALDH1A1 (0.59) ALDH1A1LMNAHSD17B10MAPTMAPK1
SCHEMBL16463538 0.69 ALDH1A1 (0.47) ALDH1A1LMNAHSD17B10TSHRPPARD

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-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US disclosed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP disclosed