SCHEMBL858403

SCHEMBL858403

CON[C@@H](C)C(=O)OP(N)(=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 4/20 0.40
ANPEP P15144 1/20 0.40
LAP3 P28838 1/20 0.40
ELANE P08246 2/20 0.39
PKM P14618 1/20 0.38
HTT P42858 1/20 0.38
SRC P12931 1/20 0.38
PRTN3 P24158 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 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
SCHEMBL878441 0.87 BTN3A1 (0.43) BTN3A1ANPEPLAP3ELANEPKM
SCHEMBL643837 0.83 BTN3A1 (0.40) BTN3A1ANPEPLAP3ELANEPKM
SCHEMBL5996997 0.83 BTN3A1 (0.40) BTN3A1ANPEPLAP3ELANEPKM
SCHEMBL27559223 0.81 ANPEP (0.48) ANPEPLAP3ELANESRCPRTN3
SCHEMBL27559224 0.81 ANPEP (0.48) ANPEPLAP3ELANESRCPRTN3
SCHEMBL877722 0.75 TDP1 (0.41) BTN3A1ANPEPLAP3ELANESRC
SCHEMBL6708631 0.74 LMNA (0.42) LMNATDP1NPSR1MAPK1
SCHEMBL7807907 0.74 KMT2A (0.40) BTN3A1HTTL3MBTL1LMNAMAPK1
SCHEMBL10004082 0.73 CA1 (0.38) PKMHTTHPGD
SCHEMBL23470935 0.72 BTN3A1 (0.53) BTN3A1ANPEPLAP3ELANESRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3904365-B1 CHEMICAL COMPOUNDS NuCana plc (GB) 2022-09-07 EP disclosed
EP-3904365-A1 CHEMICAL COMPOUNDS NuCana plc (GB) 2021-11-03 EP disclosed
US-RE47589-E1 Phosphoramidate compounds and methods of use NuCana plc (GB) 2019-09-03 US disclosed
EP-3486251-A1 CHEMICAL COMPOUNDS NuCana plc (GB) 2019-05-22 EP disclosed
EP-3040340-B1 CHEMICAL COMPOUNDS NuCana plc (GB) 2018-11-14 EP disclosed
EP-2955190-B1 Chemical compounds NuCana plc (GB) 2018-03-28 EP disclosed
EP-1646639-B1 NUCLEOTIDE PHOSPHORAMIDATES AS ANTICANCER AGENTS NUCANA BIOMED LTD (GB) 2016-08-17 EP disclosed
EP-3040340-A1 CHEMICAL COMPOUNDS NuCana BioMed Limited (GB) 2016-07-06 EP disclosed
EP-2955190-A2 Chemical compounds NuCana BioMed Limited (GB) 2015-12-16 EP disclosed
EP-2099461-B1 LNA NUCLEOSIDE PHOSPHORAMIDATES SANTARIS PHARMA AS (DK) 2012-03-28 EP disclosed
US-7951787-B2 Phosphoramidate compounds and methods of use CARDIFF PROTIDES LIMITED (GB) 2011-05-31 US disclosed
EP-2099461-A2 LNA NUCLEOSIDE PHOSPHORAMIDATES Santaris Pharma A/S (DK) 2009-09-16 EP disclosed
WO-2007054100-A2 LNA NUCLEOSIDE PHOSPHORAMIDATES SANTARIS PHARMA A/S (DK) 2007-05-18 WO disclosed
US-20060142238-A1 Chemical compounds NuCana plc (GB) 2006-06-29 US disclosed
EP-1646639-A2 NUCLEOTIDE PHOSPHORAMIDATES AS ANTICANCER AGENTS University College Cardiff Consultants, Ltd. (GB) 2006-04-19 EP disclosed
WO-2005012327-A2 NUCLEOTIDE PHOSPHORAMIDATES AS ANTICANCER AGENTS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2005-02-10 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 (1 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-20060142238-A1 Chemical compounds NUDT1, DCK, PNP BTN3A1 3438/4885ANPEP 334/4885LAP3 2008/4885

“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.