SCHEMBL9068415

SCHEMBL9068415

CC(=O)C(Cl)=NNc1cccc(C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.58
MAPT P10636 7/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
MAPK1 P28482 2/20 0.58
GAA P10253 4/20 0.53
ALDH1A1 P00352 4/20 0.53
LMNA P02545 2/20 0.53
HSD17B10 Q99714 1/20 0.53
POLB P06746 2/20 0.47
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 1/20 0.45
KMT2A Q03164 7/20 0.45
MEN1 O00255 5/20 0.45
RXFP1 Q9HBX9 1/20 0.45
CRHR1 P34998 1/20 0.43
MAOB P27338 1/20 0.43
HPGD P15428 2/20 0.42
PKM P14618 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
SCHEMBL9068410 1.00 SMN1; SMN2 (0.58) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL3467641 0.87 SMN1; SMN2 (0.55) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL3105641 0.87 SMN1; SMN2 (0.55) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL3105639 0.87 SMN1; SMN2 (0.55) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL9067769 0.84 MAPT (0.70) SMN1; SMN2MAPTNPC1RAB9AGAA
SCHEMBL9067633 0.84 MAPT (0.70) SMN1; SMN2MAPTNPC1RAB9AGAA
SCHEMBL518631 0.83 SMN1; SMN2 (0.74) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL2487154 0.82 KYAT1 (0.52) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL1998080 0.82 KYAT1 (0.52) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A
SCHEMBL8060308 0.82 KYAT1 (0.52) SMN1; SMN2MAPTL3MBTL1NPC1RAB9A

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-5506228-A 2,6-diaryl pyridazinones with immunosuppressant activity MERCK & CO., INC. (US) 1996-04-09 US disclosed