SCHEMBL3405906

SCHEMBL3405906

NCCCCCCOP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 2/20 0.44
ITPR3 Q14573 1/20 0.44
ITPR1 Q14643 1/20 0.44
LPAR3 Q9UBY5 5/20 0.41
LPAR2 Q9HBW0 4/20 0.41
LPAR1 Q92633 3/20 0.41
MVD P53602 3/20 0.41
FDPS P14324 1/20 0.36
GGPS1 O95749 2/20 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
SCHEMBL18798612 1.00 BTN3A1 (0.44) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL260134 1.00 BTN3A1 (0.44) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL23845594 1.00 BTN3A1 (0.44) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL10880174 0.98 BTN3A1 (0.46) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL8829466 0.96 BTN3A1 (0.47) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL10878442 0.94 BTN3A1 (0.48) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL10880122 0.92 ITPR3 (0.50) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL18798611 0.92 ITPR3 (0.50) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL18798606 0.92 ITPR3 (0.50) BTN3A1ITPR3ITPR1LPAR3LPAR2
SCHEMBL8169756 0.88 ITPR3 (0.53) BTN3A1ITPR3ITPR1LPAR3LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254591-A2 INHIBITION AND TREATMENT OF GASTROINTESTINAL BIOFILMS Prothera, Inc. (US) 2010-12-01 EP claimed
WO-2009100456-A2 INHIBITION AND TREATMENT OF GASTROINTESTINAL BIOFILMS PROTHERA, INC. (US) 2009-08-13 WO claimed
US-20230010193-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-01-12 US disclosed
US-11396677-B2 Chemical methods for producing tagged nucleotides THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2022-07-26 US disclosed
EP-3122759-B1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES UNIV COLUMBIA (US) 2022-06-01 EP disclosed
CN-106715453-B Chemical process for producing tagged nucleotides 哥伦比亚大学董事会 2021-04-30 CN disclosed
US-20190276887-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-09-12 US disclosed
US-10240195-B2 Chemical methods for producing tagged nucleotides THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-03-26 US disclosed
CN-108350017-A Polypeptide-labeled nucleotides and their use in nucleic acid sequencing by nanopore detection 豪夫迈·罗氏有限公司 2018-07-31 CN disclosed
EP-3122759-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES The Trustees of Columbia University in the City of New York (US) 2017-02-01 EP disclosed
US-20150368710-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-12-24 US disclosed
WO-2015148402-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES THE TRUSTEES OF COLUMBIA UNIVERISTY IN THE CITY OF NEW YORK (US) 2015-10-01 WO 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 (5 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-20150368710-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES NT5C3B, NCL, NUDT1 BTN3A1 4206/4885ITPR3 2053/4885ITPR1 1184/4885
US-20230010193-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES NT5C3B, NCL, NUDT1 BTN3A1 4206/4885ITPR3 2053/4885ITPR1 1184/4885
US-11396677-B2 Chemical methods for producing tagged nucleotides NT5C3B, NCL, NUDT1 BTN3A1 4206/4885ITPR3 2053/4885ITPR1 1184/4885
US-20190276887-A1 CHEMICAL METHODS FOR PRODUCING TAGGED NUCLEOTIDES NT5C3B, NCL, NUDT1 BTN3A1 4206/4885ITPR3 2053/4885ITPR1 1184/4885
US-10240195-B2 Chemical methods for producing tagged nucleotides NT5C3B, NCL, NUDT1 BTN3A1 4206/4885ITPR3 2053/4885ITPR1 1184/4885

“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.