SCHEMBL1809438

SCHEMBL1809438

CCOC(=O)C(C)(N)Cc1ccccc1.O=P(O)(O)Cl

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.53
ALDH1A1 P00352 2/20 0.50
RECQL P46063 1/20 0.50
FDPS P14324 1/20 0.44
PIN1 Q13526 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HIF1A Q16665 1/20 0.41
POLB P06746 1/20 0.41
SLC6A2 P23975 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
BLM P54132 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GPR119 Q8TDV5 3/20 0.40
PTPN1 P18031 2/20 0.40
PTPRC P08575 1/20 0.40
PPID Q08752 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 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
SCHEMBL1831636 0.91 MMP8 (0.61) MMP8ALDH1A1RECQLPIN1SMN1; SMN2
SCHEMBL10684512 0.91 MMP8 (0.61) MMP8ALDH1A1RECQLPIN1SMN1; SMN2
SCHEMBL604459 0.91 MMP8 (0.61) MMP8ALDH1A1RECQLPIN1SMN1; SMN2
SCHEMBL1810261 0.89 PTPN1 (0.51) MMP8ALDH1A1FDPSSMN1; SMN2HIF1A
SCHEMBL1811459 0.88 CYP3A4 (0.49) MMP8ALDH1A1RECQLSMN1; SMN2SLC6A2
SCHEMBL1811750 0.86 FDPS (0.46) MMP8ALDH1A1RECQLFDPSSMN1; SMN2
SCHEMBL1806977 0.83 PTPN1 (0.49) ALDH1A1POLBSLC6A2BLMMEN1
SCHEMBL1809382 0.82 LMNA (0.43) ALDH1A1SMN1; SMN2POLBKMT2ALMNA
SCHEMBL1809666 0.80 PTPN1 (0.58) BLMPTPN1PTPRC
SCHEMBL1773480 0.80 CYP3A4 (0.55) MMP8ALDH1A1RECQLSMN1; SMN2POLB

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-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
US-7951787-B2 Phosphoramidate compounds and methods of use CARDIFF PROTIDES LIMITED (GB) 2011-05-31 US 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 MMP8 3674/4885ALDH1A1 1643/4885RECQL 861/4885

“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.