SCHEMBL9540784

SCHEMBL9540784

CC(C)N(C(=O)c1ccc(Br)cc1)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
RECQL P46063 1/20 0.47
ADAM17 P78536 1/20 0.47
SLC6A9 P48067 1/20 0.46
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PDK2 Q15119 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
ADORA2A P29274 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
HSD11B1 P28845 1/20 0.40

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
SCHEMBL10453097 0.92 SLC6A9 (0.51) MEN1KMT2AKDM4ELMNAALOX15
SCHEMBL12917871 0.85 ALDH1A1 (0.58) MEN1KMT2ALMNASLC6A9ALDH1A1
SCHEMBL10453321 0.84 MAPT (0.50) MEN1KMT2AKDM4ELMNASLC6A9
SCHEMBL9208637 0.84 SLC6A9 (0.44) MEN1KMT2AKDM4ELMNAALOX15
SCHEMBL9542226 0.84 TRPM8 (0.47) MEN1KMT2AKDM4ELMNAALOX15
SCHEMBL9540766 0.82 SLC6A2 (0.44) MEN1KMT2AKDM4ELMNAALOX15
SCHEMBL9540877 0.81 SLC6A9 (0.47) MEN1KMT2AKDM4ELMNAALOX15
SCHEMBL9540799 0.79 TRPM8 (0.51) MEN1KMT2ASLC6A9ALDH1A1GAA
SCHEMBL14407204 0.79 PDK2 (0.45) MEN1KMT2AKDM4ELMNAALOX15
SCHEMBL9542160 0.79 MEN1 (0.71) MEN1KMT2AKDM4ELMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993010077-A1 N,N-DI-ALKYL(PHENOXY)BENZAMIDE DERIVATIVES G.D. SEARLE & CO. (US) 1993-05-27 WO claimed
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