SCHEMBL10909593

SCHEMBL10909593

CCN(CCOc1ccc2c(c1)C(=O)N(CCO[N+](=O)[O-])C2=O)Cc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CHRNA7 P36544 1/20 0.43
▸ MAOB P27338 4/20 0.42
▸ BCHE P06276 2/20 0.40
▸ ACHE P22303 2/20 0.40
▸ KCNH2 Q12809 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALK Q9UM73 1/20 0.39

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
SCHEMBL10911993 0.91 MAOB (0.54) KMT2AMAPTCHRNA7MAOBBCHE
SCHEMBL10911877 0.88 MAPT (0.55) KMT2AMAPTCHRNA7ALK
SCHEMBL10913524 0.85 MAOB (0.55) MAOBBCHEACHE
SCHEMBL10912368 0.85 ALDH1A1 (0.41) KMT2AMAPTCHRNA7MEN1
SCHEMBL10912957 0.85 MAOB (0.56) MAOBBCHEACHE
SCHEMBL10912756 0.84 MAPT (0.47) KMT2AMAPTCHRNA7KCNH2
SCHEMBL10909554 0.83 MAPT (0.48) KMT2AMAPTCHRNA7
SCHEMBL10912912 0.83 KMT2A (0.45) KMT2AMAPTCHRNA7
SCHEMBL10911744 0.83 MAPT (0.53) KMT2AMAPTCHRNA7
SCHEMBL10911955 0.82 MAPT (0.52) KMT2AMAPTCHRNA7

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
EP-0171977-A1 Phthalimide derivatives, compositions containing them and a process for preparing them SANKYO COMPANY LIMITED (JP) 1986-02-19 — — EP disclosed
Send feedback