SCHEMBL9196236

SCHEMBL9196236

CCOC(=O)N1CCC(CCl)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.59
ALDH1A1 P00352 4/20 0.58
HTT P42858 2/20 0.58
POLB P06746 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
L3MBTL1 Q9Y468 3/20 0.54
THRB P10828 1/20 0.54
ATM Q13315 1/20 0.54
NOS3 P29474 1/20 0.51
NOS2 P35228 1/20 0.51
CHRM1 P11229 1/20 0.50
TSHR P16473 1/20 0.50
PKM P14618 1/20 0.47
TP53 P04637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 1/20 0.46
RECQL P46063 1/20 0.46
KDM4E B2RXH2 1/20 0.45
BRD4 O60885 1/20 0.44
MEN1 O00255 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
SCHEMBL3994255 0.85 POLB (0.56) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL8434541 0.85 GAA (0.62) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL1267275 0.83 GAA (0.61) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL9217362 0.83 GAA (0.53) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL3629079 0.82 GAA (0.70) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL9198765 0.82 GAA (0.56) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL3319018 0.81 GAA (0.59) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL7986406 0.81 GAA (0.59) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL10576741 0.81 GAA (0.64) GAAALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL1111736 0.80 GAA (0.67) GAAALDH1A1HTTPOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1037268-C Antipicornaviral pyridazinamines JANSSEM PHARMACEUTICA N V (BE) 1998-02-04 CN disclosed
EP-0435381-B1 Antipicornaviral pyridazinamines JANSSEN PHARMACEUTICA NV (BE) 1995-11-02 EP disclosed
US-5196535-A Viricides JANSSEN PHARMACEUTICA N.V. (BE) 1993-03-23 US disclosed
US-5100893-A Viricides, effective against picorna virus, durability JANSSEN PHARMACEUTICA N.V. (BE) 1992-03-31 US disclosed
CN-1052857-A The preparation method of the pyridazine amine that antipicornaviral is used JANSSEN PHARMACEUTICA NV (BE) 1991-07-10 CN disclosed
EP-0435381-A1 Antipicornaviral pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-07-03 EP disclosed