SCHEMBL10352138

SCHEMBL10352138

O=C(Nc1ccccn1)c1ccccc1[Se][Se]c1ccccc1C(=O)Nc1ccccn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
KDM4E B2RXH2 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
CHRNB2 P17787 1/20 0.61
CHRNB4 P30926 1/20 0.61
CHRNA3 P32297 1/20 0.61
CHRNA4 P43681 1/20 0.61
NPC1 O15118 8/20 0.60
RAB9A P51151 8/20 0.60
GAA P10253 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
TP53 P04637 1/20 0.60
METAP2 P50579 2/20 0.58
PKM P14618 1/20 0.56
SGMS2 Q8NHU3 1/20 0.55
KCNMA1 Q12791 1/20 0.54
SORT1 Q99523 1/20 0.52
CYP1A2 P05177 1/20 0.51
GRM5 P41594 1/20 0.51

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
SCHEMBL29502862 1.00 MEN1 (0.67) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL10352814 0.83 KCNMA1 (0.71) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL10352604 0.83 KCNMA1 (0.67) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL10352606 0.83 MEN1 (0.54) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL10352178 0.83 NPC1 (0.56) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL27473596 0.82 MEN1 (0.69) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL9363740 0.82 MEN1 (0.56) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL8359215 0.82 SGMS2 (0.60) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL17675194 0.80 MEN1 (0.71) MEN1KMT2AKDM4EL3MBTL1CHRNB2
SCHEMBL8433498 0.80 MEN1 (1.00) MEN1KMT2AKDM4EL3MBTL1CHRNB2

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
EP-0257306-B1 DISELENOBIS BENZOIC ACID AMIDES OF PRIMARY HETEROCYCLIC AMINES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOUNDS COMPRISING THE SAME A. Nattermann & Cie. GmbH (DE) 1990-09-12 EP disclosed
US-4910313-A Containing a heterocyclic ring NATTERMANN & CIE GMBH (DE) 1990-03-20 US disclosed
EP-0257306-A1 Diselenobis benzoic acid amides of primary heterocyclic amines, process for producing the same and pharmaceutical compounds comprising the same A. Nattermann & Cie. GmbH (DE) 1988-03-02 EP disclosed