SCHEMBL4804282

SCHEMBL4804282

CCCCCCc1ccc(OCCOCCOCCOC)cc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.62
MEN1 O00255 2/20 0.56
CYP3A4 P08684 2/20 0.56
KMT2A Q03164 2/20 0.56
TP53 P04637 1/20 0.56
ALOX5 P09917 1/20 0.56
MAPT P10636 1/20 0.56
TYR P14679 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
HTT P42858 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CNR1 P21554 4/20 0.56
USP2 O75604 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
MAPK1 P28482 1/20 0.51
CASP1 P29466 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
SLCO1B3 Q9NPD5 1/20 0.51

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
SCHEMBL4804633 1.00 CNR2 (0.62) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL4807422 1.00 CNR2 (0.62) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL5546322 0.96 CNR2 (0.67) CNR2MEN1CYP3A4KMT2ATP53
Phenol SCHEMBL4854650 0.90 CNR2 (0.60) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL4808524 0.90 MEN1 (0.51) CNR2MEN1CYP3A4KMT2ATSHR
SCHEMBL9939329 0.83 CNR2 (0.72) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL30942500 0.82 TYR (0.68) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL28186787 0.80 ALOX5 (0.70) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL28186760 0.80 ALOX5 (0.70) CNR2MEN1CYP3A4KMT2ATP53
SCHEMBL28187615 0.80 ALOX5 (0.70) CNR2MEN1CYP3A4KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436083-B2 Multifunctional self-decontaminating surface coating THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2013-05-07 US disclosed
US-20120172489-A1 MULTIFUNCTIONAL SELF-DECONTAMINATING SURFACE COATING THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2012-07-05 US disclosed
US-7452951-B2 Multifunctional self-decontaminating surface coating THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2008-11-18 US disclosed
US-20080102281-A1 MULTIFUNCTIONAL SELF-DECONTAMINATING SURFACE COATING THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2008-05-01 US disclosed
US-7339015-B2 Multifunctional self-decontaminating surface coating THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2008-03-04 US disclosed
US-20070122438-A1 Multifunctional self-decontaminating surface coating THE GOVERNMENT OF THE UNITED STATES, AS RESPRESENTED BY THE SECRETARY OF THE NAVY 2007-05-31 US disclosed
WO-2007030117-A2 MULTIFUNCTIONAL SELF-DECONTAMINATING SURFACE COATING THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2007-03-15 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 (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-20120172489-A1 MULTIFUNCTIONAL SELF-DECONTAMINATING SURFACE COATING YWHAZ, EPCAM, LBR CNR2 3930/4885MEN1 3234/4885CYP3A4 3092/4885
US-20070122438-A1 Multifunctional self-decontaminating surface coating YWHAZ, EPCAM, LBR CNR2 3930/4885MEN1 3234/4885CYP3A4 3092/4885

“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.