SCHEMBL6434617

SCHEMBL6434617

C=CC(=O)NC(=O)C=CC=C(C=Cc1ccccc1)C(=O)OCCCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
TDP1 Q9NUW8 2/20 0.46
POLB P06746 1/20 0.44
EGFR P00533 2/20 0.43
HDAC3 O15379 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
BCHE P06276 4/20 0.39
APP P05067 1/20 0.39
ACHE P22303 2/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6471821 0.87 KDM4E (0.53) KDM4ETDP1POLBEGFRHDAC3
SCHEMBL1234803 0.85 KDM4E (0.54) KDM4ETDP1POLBEGFRHDAC3
SCHEMBL9754239 0.84 KDM4E (0.51) KDM4ETDP1POLBEGFRHDAC3
SCHEMBL8846901 0.84 KDM4E (0.52) KDM4ETDP1POLBEGFRHDAC3
Acrylonitrile SCHEMBL8680141 0.82 KDM4E (0.47) KDM4ETDP1POLBEGFRHDAC3
SCHEMBL11441787 0.82 KDM4E (0.45) KDM4ETDP1POLBALDH1A1APP
SCHEMBL11394468 0.81 KDM4E (0.48) KDM4ETDP1POLBEGFRHDAC3
SCHEMBL3221254 0.81 KDM4E (0.57) KDM4ETDP1POLBEGFRHDAC3
Butadiene SCHEMBL9698277 0.81 KDM4E (0.53) KDM4ETDP1POLBEGFRHDAC3
SCHEMBL7699557 0.81 KDM4E (0.48) KDM4ETDP1POLBEGFRHDAC3

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-1273403-B1 Preservation of wood products ROHM & HAAS (US) 2005-08-31 EP claimed
EP-1273403-B1 Preservation of wood products ROHM & HAAS (US) 2005-08-31 EP disclosed
US-6753016-B2 CONTACTING WOOD MATERIAL WITH AN AQUEOUS TREATMENT SOLUTION COMPRISING AN IRON SALT AND AN OXIDANT TO PROVIDE IMPREGNATED WOOD MATERIAL; AND SEPARATING THE IMPREGNATED WOOD MATERIAL FROM THE AQUEOUS TREATMENT SOLUTION ROHM AND HAAS COMPANY 2004-06-22 US disclosed
US-20030086979-A1 Preservation of wood products ROHM AND HAAS COMPANY 2003-05-08 US disclosed
EP-1273403-A1 Preservation of wood products ROHM AND HAAS COMPANY (US) 2003-01-08 EP 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-20030086979-A1 Preservation of wood products SOD1, SOD3, AOC1 KDM4E 1034/4885TDP1 3330/4885POLB 2607/4885

“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.