Glycerin

Glycerin

SCHEMBL9717347

O=C(O)C1CCCC2OC21.O=C(O)C1CCCC2OC21.O=C(O)C1CCCC2OC21.OCC(O)CO

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.36
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
PMP22 Q01453 1/20 0.31
TFPI2 P48307 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
THPO P40225 1/20 0.31
ACE P12821 1/20 0.30
MEN1 O00255 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 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
Ethylene Glycol SCHEMBL9717369 0.86 PEPD (0.40) PEPDLMNAKDM4EGMNNPMP22
SCHEMBL11146792 0.86 PEPD (0.41) PEPDLMNAKDM4EGMNNPMP22
Glycerin SCHEMBL29573229 0.78 PEPD (0.45) PEPDLMNAALDH1A1
Methacrylic Acid SCHEMBL28019772 0.75 PEPD (0.33) PEPDLMNAKDM4EGMNNPMP22
SCHEMBL28136773 0.73
SCHEMBL6653407 0.68 KDM4E (0.30) LMNAKDM4EGMNNPMP22TFPI2
Glycerin SCHEMBL259191 0.68 TFPI2 (0.39) LMNAKDM4EGMNNPMP22TFPI2
SCHEMBL9717365 0.67 TP53 (0.41) TP53
SCHEMBL8050405 0.66
Cyclopropane Carboxylic Acid SCHEMBL1264783 0.65 LMNA (0.48) LMNAPMP22TSHRACEMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0506611-A2 Imino functional polyethers and their use CIBA-GEIGY AG (CH) 1992-09-30 EP disclosed
US-4398013-A HALOGENONIUM SALT GENERAL ELECTRIC COMPANY (US) 1983-08-09 US disclosed
US-4389520-A FORMYLMETHYLENETRIPHENYLPHOSPHORANE, FORMYLMETHYL-TRIPHENYLPHOSPHONIUM HALIDE CIBA-GEIGY CORPORATION (US) 1983-06-21 US disclosed