SCHEMBL10877152

SCHEMBL10877152

CCOP(=O)(CCC(=O)OCC1CO1)OCC

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
PPARD Q03181 1/20 0.42
MGLL Q99685 3/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL10880692 0.84 ALDH1A1 (0.45) ALDH1A1MGLLLMNAPOLBTP53
SCHEMBL10877146 0.82 MGLL (0.39) ALDH1A1MGLLLMNAPOLBTP53
SCHEMBL710885 0.79 PPARD (0.54) ALDH1A1PPARDPOLB
SCHEMBL57588 0.78 ALDH1A1 (0.52) ALDH1A1MGLLLMNAPOLBTP53
SCHEMBL78536 0.78 ALDH1A1 (0.52) ALDH1A1MGLLLMNAPOLBTP53
SCHEMBL78535 0.78 ALDH1A1 (0.52) ALDH1A1MGLLLMNAPOLBTP53
SCHEMBL471906 0.77 ALDH1A1 (0.55) ALDH1A1MGLLLMNAPOLBTP53
Methane SCHEMBL6359900 0.76 ALDH1A1 (0.50) ALDH1A1MGLLLMNAPOLBTP53
Water SCHEMBL28213494 0.76 ALDH1A1 (0.50) ALDH1A1MGLLLMNAPOLBTP53
SCHEMBL28191220 0.76 ALDH1A1 (0.50) ALDH1A1MGLLLMNAPOLBTP53

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-4585703-A MELAMINE RESIN AND PHOSPHONATE FIREPROOFING AGENT DAINIPPON INK & CHEMICALS, INC. (JP) 1986-04-29 US claimed
US-4585703-A MELAMINE RESIN AND PHOSPHONATE FIREPROOFING AGENT DAINIPPON INK & CHEMICALS, INC. (JP) 1986-04-29 US disclosed