SCHEMBL4444955

SCHEMBL4444955

CC(Oc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)=C(C(=O)O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.63
FFAR1 O14842 2/20 0.58
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 1/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
RAB9A P51151 1/20 0.49
TLR4 O00206 1/20 0.49
TLR2 O60603 1/20 0.49
SRD5A2 P31213 1/20 0.47
FAAH O00519 1/20 0.47
MGLL Q99685 1/20 0.47
LPAR1 Q92633 1/20 0.47
LPAR5 Q9H1C0 1/20 0.47
LPAR3 Q9UBY5 1/20 0.47
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL4444957 0.87 KDM4E (0.59) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL2107666 0.80 KDM4E (0.62) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL203584 0.79 KDM4E (0.54) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL203585 0.79 KDM4E (0.51) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL9063379 0.79 KDM4E (0.51) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL177838 0.78 KDM4E (1.00) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL7632953 0.77 ALDH1A1 (0.77) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL27188054 0.77 ALDH1A1 (0.77) KDM4EFFAR1MEN1KMT2AALDH1A1
SCHEMBL4454900 0.75 MEN1 (0.62) KDM4EMEN1KMT2AALDH1A1RAB9A
4-Nitrotoluene SCHEMBL28077886 0.75 ALDH1A1 (0.60) KDM4EFFAR1MEN1KMT2AALDH1A1

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-20090223408-A1 Use of Sub-Micron Copper Salt Particles in Wood Preservation PHIBROWOOD, LLC (US) 2009-09-10 US disclosed
EP-1830989-A2 USE OF SUB-MICRON COPPER SALT PARTICLES IN WOOD PRESERVATION Phibro-Tech, Inc. (US) 2007-09-12 EP disclosed
WO-2006065684-A2 USE OF SUB-MICRON COPPER SALT PARTICLES IN WOOD PRESERVATION PHIBRO-TECH, INC. (US) 2006-06-22 WO disclosed
US-20060062926-A1 Use of sub-micron copper salt particles in wood preservation KOPPERS INC. (F/K/A KOPPERS INDUSTRIES, INC) 2006-03-23 US disclosed