SCHEMBL4754900

SCHEMBL4754900

CCCCCCCCCCN(C)CC(O)C(O)C(O)C(O)CO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 3/20 0.49
S1PR2 O95136 1/20 0.40
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
S1PR5 Q9H228 1/20 0.40
LMNA P02545 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TOP1 P11387 1/20 0.39
DNM1 Q05193 3/20 0.39
TDP1 Q9NUW8 1/20 0.38
CYP2D6 P10635 2/20 0.38
SPHK1 Q9NYA1 2/20 0.38
CETP P11597 2/20 0.38
GMNN O75496 1/20 0.38
POLB P06746 1/20 0.38
THPO P40225 1/20 0.38
MTOR P42345 1/20 0.38
BLM P54132 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL31338862 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL17817249 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL12258773 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL9813074 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL13169240 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL789161 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL23016843 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL8640646 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL13169239 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5
SCHEMBL31201935 1.00 GGPS1 (0.49) GGPS1S1PR2S1PR1S1PR3S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114796474-A Vaccine compositions with improved stability and immunogenicity 诺瓦瓦克斯股份有限公司 2022-07-29 CN disclosed
CN-114699519-A Vaccine compositions with improved stability and immunogenicity 诺瓦瓦克斯股份有限公司 2022-07-05 CN disclosed
CN-114617959-A Vaccine compositions with improved stability and immunogenicity 诺瓦瓦克斯股份有限公司 2022-06-14 CN disclosed
CN-108697790-B Vaccine compositions with improved stability and immunogenicity 诺瓦瓦克斯股份有限公司 2022-02-18 CN disclosed
CN-111601786-A Branched trialkylamine precursors, intermediates, products made therefrom, and methods of making 伊士曼化工公司 2020-08-28 CN disclosed
US-20190218170-A1 BRANCHED TRIALKYLAMINE PRECURSORS, INTERMEDIATES, PRODUCTS MADE THEREFROM AND PROCESSES OF MANUFACTURE EASTMAN CHEMICAL COMPANY (US) 2019-07-18 US disclosed
US-9782748-B2 Synthesis of polymeric ionic liquids using a photochemical polymerization process THE UNIVERSITY OF TOLEDO (US) 2017-10-10 US disclosed
US-20150119231-A1 Synthesis of Polymeric Ionic Liquids Using a Photochemical Polymerization Process THE UNIVERSITY OF TOLEDO (US) 2015-04-30 US disclosed
US-8734673-B2 Boron selective ionic liquids and polymeric ionic liquids, methods of making and methods of use thereof THE UNIVERSITY OF TOLEDO (US) 2014-05-27 US disclosed
US-20120111796-A1 Boron Selective Ionic Liquids and Polymeric Ionic Liquids, Methods of Making and Methods of Use Thereof UNIVERSITY OF TOLEDO (US) 2012-05-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190218170-A1 BRANCHED TRIALKYLAMINE PRECURSORS, INTERMEDIATES, PRODUCTS MADE THEREFROM AND PROCESSES OF MANUFACTURE ACADM, ALK, FASN GGPS1 1291/4885S1PR2 595/4885S1PR1 499/4885
US-20120111796-A1 Boron Selective Ionic Liquids and Polymeric Ionic Liquids, Methods of Making and Methods of Use Thereof BCCIP, SLC6A12, BOLA2; BOLA2B GGPS1 3813/4885S1PR2 1694/4885S1PR1 2262/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.