SCHEMBL11652255

SCHEMBL11652255

CCOC(=O)Cc1nnc(-c2ccccn2)[nH]c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HSD17B10 Q99714 5/20 0.48
TSHR P16473 2/20 0.48
MAPK1 P28482 2/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 6/20 0.45
KDM4E B2RXH2 4/20 0.45
HTT P42858 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
POLB P06746 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
HPGD P15428 1/20 0.44
MAPT P10636 3/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
AGTR1 P30556 1/20 0.42
RECQL P46063 1/20 0.42
GAA P10253 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL8525541 0.76 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2HSD17B10TSHRLMNA
SCHEMBL11655439 0.74 L3MBTL1 (0.60) ALDH1A1SMN1; SMN2LMNAKDM4EHTT
Hydrochloric Acid SCHEMBL8523964 0.72 PDE5A (0.43) ALDH1A1SMN1; SMN2HSD17B10TSHRLMNA
SCHEMBL13728291 0.71 LMNA (0.47) ALDH1A1SMN1; SMN2HSD17B10TSHRLMNA
SCHEMBL13984005 0.70 CBFB (0.51) ALDH1A1SMN1; SMN2HSD17B10LMNAKDM4E
SCHEMBL8525364 0.70 L3MBTL1 (0.44) ALDH1A1SMN1; SMN2LMNAKDM4EHTT
SCHEMBL30858931 0.70 LMNA (0.56) ALDH1A1SMN1; SMN2HSD17B10TSHRLMNA
SCHEMBL134991 0.70 LMNA (0.56) ALDH1A1SMN1; SMN2HSD17B10TSHRLMNA
SCHEMBL8525373 0.69 HTT (0.46) ALDH1A1SMN1; SMN2HSD17B10TSHRLMNA
SCHEMBL7445391 0.69 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2HSD17B10TSHRMAPK1

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