SCHEMBL9541761

SCHEMBL9541761

COc1cc(OC)c(C(O)c2ccc(C(=O)N(C3CCCCC3)C3CCCC3)cc2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
RECQL P46063 1/20 0.46
ADAM17 P78536 1/20 0.46
HSD11B1 P28845 3/20 0.43
TSHR P16473 3/20 0.40
HTT P42858 2/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
S1PR1 P21453 3/20 0.39
S1PR3 Q99500 3/20 0.39
GAA P10253 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
MCHR1 Q99705 1/20 0.37

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
SCHEMBL9540800 0.87 ALOX15 (0.47) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL9540786 0.86 ALOX15 (0.45) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL9542144 0.76 LMNA (0.48) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL9543513 0.75 HIF1A (0.43) ALOX15TSHRMAPTNPC1RAB9A
SCHEMBL9542158 0.75 MEN1 (0.49) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL10455127 0.74 LMNA (0.60) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL9542288 0.73 MEN1 (0.47) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL9541759 0.73 CA2 (0.51) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL8361113 0.73 LMNA (0.77) LMNAMEN1KMT2AKDM4EALOX15
SCHEMBL9542307 0.72 MEN1 (0.42) MEN1KMT2AALOX15TSHRMAPT

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-5223539-A Antagonist of platelet activating factor G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
WO-1993010077-A1 N,N-DI-ALKYL(PHENOXY)BENZAMIDE DERIVATIVES G.D. SEARLE & CO. (US) 1993-05-27 WO disclosed