SCHEMBL7804694

SCHEMBL7804694

O=C(O)CCOc1ccc(N2CCN(C(=O)c3cccc4ccccc34)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
KDM4E B2RXH2 3/20 0.55
HIF1A Q16665 1/20 0.55
MAPT P10636 5/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
GAA P10253 1/20 0.53
USP2 O75604 2/20 0.51
POLB P06746 1/20 0.51
DRD3 P35462 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51
TSHR P16473 2/20 0.50
LMNA P02545 3/20 0.49
HSD17B10 Q99714 2/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GCGR P47871 1/20 0.48

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
SCHEMBL7804346 0.96 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AKDM4EHIF1A
SCHEMBL7804363 0.90 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AKDM4EHIF1A
SCHEMBL3579223 0.89 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4EHIF1A
SCHEMBL7817501 0.89 ALDH1A1 (0.64) ALDH1A1MEN1KMT2AKDM4EHIF1A
SCHEMBL7813512 0.86 MAPT (0.55) ALDH1A1MEN1KMT2AKDM4EHIF1A
SCHEMBL13437970 0.84 GCGR (0.67) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL13437969 0.84 GCGR (0.67) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL13437978 0.84 GCGR (0.67) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL6472173 0.84 GCGR (0.67) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL29748738 0.84 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AKDM4EHIF1A

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
EP-0607536-B1 Arylamide derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed