SCHEMBL8359130

SCHEMBL8359130

O=C(O)OCOC(=O)CCCCCCCCCCCCCCCCCCCCC(=O)OCOC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.48
DGKA P23743 1/20 0.48
TSHR P16473 2/20 0.45
LMNA P02545 5/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 2/20 0.39
DNM1 Q05193 1/20 0.39
KDM4E B2RXH2 1/20 0.38
DUSP3 P51452 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.38
PRKCA P17252 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCD Q05655 1/20 0.36

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
SCHEMBL8359442 0.93 TSHR (0.55) PAMTSHRLMNANFKB1PMP22
SCHEMBL8814360 0.91 PAM (0.42) PAMDGKATSHRLMNANFKB1
SCHEMBL8813366 0.89 PAM (0.41) PAMDGKATSHRLMNANFKB1
SCHEMBL3830872 0.84 TSHR (0.63) PAMTSHRLMNANFKB1PMP22
SCHEMBL9393812 0.84 TSHR (0.63) PAMTSHRLMNANFKB1PMP22
SCHEMBL11262169 0.84 TSHR (0.63) PAMTSHRLMNANFKB1PMP22
SCHEMBL6244496 0.81 LMNA (0.61) PAMTSHRLMNANFKB1PMP22
SCHEMBL577556 0.80
Ammonia Solution, Strong SCHEMBL10346452 0.79 LMNA (0.58) PAMTSHRLMNANFKB1PMP22
SCHEMBL5931380 0.79 DGKA (0.48) PAMDGKATSHRLMNAMAPT

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-5962626-A BIODEGRADABLE POLYOXYETHYLENE GLYCOL MODIFIED WITH A FATTY ACID NYCOMED IMAGING AS (NO) 1999-10-05 US claimed
US-5962626-A BIODEGRADABLE POLYOXYETHYLENE GLYCOL MODIFIED WITH A FATTY ACID NYCOMED IMAGING AS (NO) 1999-10-05 US disclosed