SCHEMBL2435903

SCHEMBL2435903

NC(N)(F)c1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
NOS3 P29474 1/20 0.44
NOS1 P29475 1/20 0.44
NOS2 P35228 1/20 0.44
PI4KA P42356 1/20 0.44
PI4K2B Q8TCG2 1/20 0.44
PI4K2A Q9BTU6 1/20 0.44
PI4KB Q9UBF8 1/20 0.44
AHR P35869 1/20 0.42
KDM4E B2RXH2 7/20 0.42
LMNA P02545 3/20 0.42
CCR1 P32246 2/20 0.42
CCR5 P51681 2/20 0.42
CCR8 P51685 2/20 0.42
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.42
METAP1 P53582 1/20 0.42
BLM P54132 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL31036835 0.88 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL3756885 0.84 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Hydrazine SCHEMBL28365317 0.83 L3MBTL1 (0.54) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL864064 0.82 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL84051 0.82 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL29401687 0.82 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL5041519 0.82 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL29424134 0.82 SMN1; SMN2 (0.58) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Bromide SCHEMBL22440321 0.80 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Methane SCHEMBL8775730 0.80 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1NOS3NOS1NOS2

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-8974771-B2 Apparatus and method for aerosol delivery to the lungs or other locations of the body Penn-Century, Inc. (US) 2015-03-10 US disclosed
US-20110223116-A1 APPARATUS AND METHOD FOR AEROSOL DELIVERY TO THE LUNGS OR OTHER LOCATIONS OF THE BODY Penn-Century, Inc. (US) 2011-09-15 US disclosed