SCHEMBL4854543

SCHEMBL4854543

Cc1cc(C)cc(-c2ccc(OCCN(C)C)c(C(=O)/C=C/c3ccc(O)cc3F)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.43
KDR P35968 3/20 0.41
CHRNA7 P36544 2/20 0.40
MIF P14174 1/20 0.40
SLC6A9 P48067 2/20 0.37
MELK Q14680 2/20 0.37
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
TNFRSF1A P19438 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL4854062 1.00 SYK (0.43) SYKKDRCHRNA7MIFSLC6A9
SCHEMBL4853780 0.91 SYK (0.43) SYKSLC6A9TNFRSF1AKDM4E
SCHEMBL4854730 0.91 SYK (0.43) SYKSLC6A9TNFRSF1AKDM4E
SCHEMBL4854072 0.90 KDR (0.41) SYKKDRCHRNA7MELKCTSL
SCHEMBL4852466 0.89 MAPT (0.42) SYKCHRNA7SLC6A9TNFRSF1AKDM4E
SCHEMBL4846630 0.89 MAPT (0.42) SYKCHRNA7SLC6A9TNFRSF1AKDM4E
SCHEMBL4849970 0.89 SYK (0.44) SYKKDRSLC6A9TNFRSF1AKDM4E
SCHEMBL4852900 0.89 SYK (0.44) SYKKDRSLC6A9TNFRSF1AKDM4E
SCHEMBL4852212 0.85 BCHE (0.44) SYK
SCHEMBL4853723 0.85 BCHE (0.44) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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