SCHEMBL4849440

SCHEMBL4849440

Cc1cc(C)cc(-c2ccc(OCCN(C)C)c(C(=O)C=Cc3ccc(O)c(CN(C)C)c3)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.41
MAOB P27338 3/20 0.41
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
PTPN1 P18031 1/20 0.38
MMP9 P14780 1/20 0.38
MAOA P21397 1/20 0.38

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
SCHEMBL4847107 1.00 SYK (0.41) SYKMAOBBCHEACHEPTPN1
SCHEMBL4849953 0.93 BCHE (0.46) SYKBCHEACHE
SCHEMBL4847429 0.93 BCHE (0.46) SYKBCHEACHE
SCHEMBL4847316 0.89 MCL1 (0.48) SYKMAOBBCHEACHE
SCHEMBL4851370 0.89 MCL1 (0.48) SYKMAOBBCHEACHE
SCHEMBL4853723 0.88 BCHE (0.44) SYKMAOBBCHEACHEMAOA
SCHEMBL4852212 0.88 BCHE (0.44) SYKMAOBBCHEACHEMAOA
SCHEMBL4853792 0.87 SMN1; SMN2 (0.42) SYKMAOB
SCHEMBL4848049 0.87 SMN1; SMN2 (0.42) SYKMAOB
SCHEMBL4848146 0.86 SLC6A9 (0.44) MAOBBCHEACHEMAOA

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-20050227990-A1 Aminoalkoxy-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2005-10-13 US claimed
EP-1515940-A2 AMINOALKOXY-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-03-23 EP claimed
WO-2003097574-A2 AMINOALKOXY-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 WO claimed
US-7423181-B2 in particular against bacterial and parasitic infections, fungi, and helminths; improved metabolic and physiochemical properties, bioavailability, solubility; 3-[4-(2-Dimethylamino-ethoxy)-2'-trifluoromethyl-biphenyl-3-yl]-1-(2-dimethylaminomethyl-phenyl)-propenone LICA PHARMACEUTICALS A/S (DK) 2008-09-09 US disclosed
US-20050227990-A1 Aminoalkoxy-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2005-10-13 US disclosed
EP-1515940-A2 AMINOALKOXY-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-03-23 EP disclosed
WO-2003097574-A2 AMINOALKOXY-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 WO disclosed