SCHEMBL9570449

SCHEMBL9570449

O=[C]NS(=O)(=O)CCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.46
GLO1 Q04760 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
IDO1 P14902 1/20 0.45
HDAC1 Q13547 3/20 0.44
HDAC8 Q9BY41 3/20 0.44
HDAC3 O15379 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
MAPK1 P28482 1/20 0.44
ADRA1A P35348 1/20 0.44
HDAC4 P56524 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44

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
SCHEMBL426660 0.89 IDO1 (0.56) CA2MEN1KMT2AGLO1KDM4E
SCHEMBL6491355 0.81 CA2 (0.55) CA2MEN1KMT2APOLBGLO1
SCHEMBL10895642 0.78 CA2 (0.56) CA2MEN1KMT2APOLBGLO1
SCHEMBL6795676 0.78 MEN1 (0.54) CA2MEN1KMT2APOLBGLO1
SCHEMBL426472 0.77 CA1 (0.64) CA2KMT2AKDM4EALDH1A1MMP1
SCHEMBL8907300 0.75 MEN1 (0.60) CA2MEN1KMT2APOLBGLO1
SCHEMBL9597342 0.75 GLO1 (0.49) CA2MEN1KMT2APOLBGLO1
SCHEMBL249113 0.75 CA2 (0.56) CA2MEN1KMT2APOLBKDM4E
SCHEMBL27737212 0.75 MEN1 (0.51) CA2MEN1KMT2APOLBHDAC1
SCHEMBL777369 0.74 CA2 (0.71) CA2MEN1KMT2APOLBKDM4E

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-5270322-A Imidazo[1,2-a]pyridines, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1993-12-14 US disclosed
EP-0555825-A1 Imidazo(1,2-a)pyridines as angiotensin-II-antagonists Dr. Karl Thomae GmbH (DE) 1993-08-18 EP disclosed