SCHEMBL2035577

SCHEMBL2035577

OC1=CC=CCC1=Nc1ccccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
KDM4E B2RXH2 4/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 3/20 0.39
POLB P06746 3/20 0.39
RAB9A P51151 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.32
RECQL P46063 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MPI P34949 1/20 0.31
CA12 O43570 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 1/20 0.31
PDE7A Q13946 1/20 0.31

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
SCHEMBL3343312 0.72 ADRA2A (0.39) MAPTKDM4ENPC1SMN1; SMN2LMNA
SCHEMBL3215622 0.70
SCHEMBL3401294 0.70 NPC1 (0.38) MAPTKDM4ENPC1SMN1; SMN2LMNA
SCHEMBL2575551 0.69
SCHEMBL3630575 0.67
SCHEMBL304890 0.65 MAPT (0.68) MAPTKDM4ENPC1SMN1; SMN2LMNA
SCHEMBL4574109 0.64
SCHEMBL3372558 0.63
Sulfuric Acid SCHEMBL11048334 0.62
SCHEMBL11074497 0.61 ALDH1A1 (0.41) MAPTKDM4ENPC1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2504418-B1 DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU HENKEL AG & CO KGAA (DE) 2017-02-15 EP disclosed
US-8481475-B2 Detergents or cleaning agents containing a bleach-enhancing transition metal complex which is optionally produced in situ HENKEL AG & CO. KGAA (DE) 2013-07-09 US disclosed
US-20120264670-A1 DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU HENKEL AG & CO. KGAA (US) 2012-10-18 US disclosed
EP-2504418-A1 DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU Henkel AG & Co. KGaA (DE) 2012-10-03 EP disclosed
WO-2011064159-A1 DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU HENKEL AG & CO. KGAA (DE) 2011-06-03 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-20120264670-A1 DETERGENTS OR CLEANING AGENTS CONTAINING A BLEACH-ENHANCING TRANSITION METAL COMPLEX WHICH IS OPTIONALLY PRODUCED IN SITU DSG1, MPO, MFAP1 MAPT 2059/4885KDM4E 1328/4885NPC1 3910/4885

“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.