SCHEMBL4381777

SCHEMBL4381777

CP(=O)(Oc1cccc2cccnc12)Oc1cccc2cccnc12

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.50
MAPT P10636 4/20 0.50
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
METAP2 P50579 2/20 0.49
METAP1 P53582 2/20 0.49
HDAC6 Q9UBN7 1/20 0.49
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 1/20 0.48
POLB P06746 2/20 0.47
HSP90AA1 P07900 1/20 0.46

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
SCHEMBL28128326 0.87 MAPT (0.51) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL8664206 0.86 KDM4E (0.53) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL7261599 0.83 MAPT (0.54) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL29100487 0.83 MAPT (0.54) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL722399 0.83 KDM4E (0.50) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL4461219 0.83 SRC (0.57) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL13212807 0.80 MAPT (0.55) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL16401062 0.79 LMNA (0.52) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL3011820 0.78 MAPT (0.46) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL15265304 0.78 MAPT (0.49) LMNAMAPTKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629379-B2 Substituted phosphonate fluorescent sensors and use thereof QUEEN MARY & WESTFIELD COLLEGE (GB) 2009-12-08 US disclosed
US-20070049761-A1 Substituted phosphonate fluorescent sensors and use thereof QUEEN MARY & WESTFIELD COLLEGE (GB) 2007-03-01 US disclosed
EP-1625134-A2 SUBSTITUTED PHOSPHONATE FLUORESCENT SENSORS AND USE THEREOF QUEEN MARY & WESTFIELD COLLEGE (GB) 2006-02-15 EP disclosed
WO-2004101579-A2 SUBSTITUTED PHOSPHONATE FLUORESCENT SENSORS AND USE THEREOF QUEEN MARY & WESTFIELD COLLEGE (GB) 2004-11-25 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-20070049761-A1 Substituted phosphonate fluorescent sensors and use thereof NR2E3, CASR, NR3C2 LMNA 1229/4885MAPT 4604/4885KDM4E 4496/4885

“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.