SCHEMBL11655439

SCHEMBL11655439

Cc1nnc(-c2ccccn2)[nH]c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.60
POLB P06746 2/20 0.60
HTT P42858 5/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KDM4E B2RXH2 4/20 0.54
LMNA P02545 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
ALDH1A1 P00352 5/20 0.53
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
GAA P10253 1/20 0.53
HIF1A Q16665 1/20 0.53
BTK Q06187 1/20 0.51
KRAS P01116 2/20 0.48
ATM Q13315 2/20 0.47
KMT2A Q03164 2/20 0.47
HSP90AA1 P07900 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 2/20 0.46
AGTR1 P30556 1/20 0.46

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
SCHEMBL5478697 0.80 KDM4E (0.59) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL8525906 0.80 HTT (0.50) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL11655297 0.80 HTT (0.50) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL11135408 0.79 RAB9A (0.53) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL420934 0.79 KDM4E (0.54) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL8524777 0.78 NPC1 (0.68) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL8525541 0.76 SMN1; SMN2 (0.47) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL7313414 0.75 POLB (1.00) L3MBTL1POLBSMN1; SMN2KDM4EALDH1A1
SCHEMBL8525087 0.75 NPC1 (0.64) L3MBTL1POLBHTTSMN1; SMN2KDM4E
SCHEMBL8525373 0.75 HTT (0.46) L3MBTL1POLBHTTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4081267-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-03-28 US disclosed