SCHEMBL9032760

SCHEMBL9032760

CCCn1c(=O)n(CC(=O)OCC)c2cc(-c3ncc(C(F)(F)F)cc3Cl)ccc21

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRIN1 Q05586 3/20 0.52
▸ GRIN2B Q13224 3/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ HPGD P15428 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ GSR P00390 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ POLB P06746 1/20 0.38

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
SCHEMBL8009389 0.87 GRIN1 (0.49) GRIN1GRIN2BL3MBTL1ALDH1A1KDM4E
SCHEMBL8007055 0.77 L3MBTL1 (0.48) GRIN1GRIN2BL3MBTL1ALDH1A1KDM4E
SCHEMBL7998180 0.77 L3MBTL1 (0.48) GRIN1GRIN2BL3MBTL1ALDH1A1KDM4E
SCHEMBL8009220 0.76 L3MBTL1 (0.51) GRIN1GRIN2BL3MBTL1ALDH1A1KDM4E
SCHEMBL27438241 0.71 L3MBTL1 (0.51) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL21061049 0.71 L3MBTL1 (0.54) GRIN1GRIN2BL3MBTL1ALDH1A1KDM4E
SCHEMBL8008014 0.69 MAPK14 (0.50) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL25409364 0.69 L3MBTL1 (0.48) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL25409361 0.69 L3MBTL1 (0.48) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL20130050 0.69 GRIN1 (1.00) GRIN1GRIN2B

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
EP-0708769-A1 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITY BASF AKTIENGESELLSCHAFT (DE) 1996-05-01 — — EP disclosed
WO-1995002590-A2 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITIES BASF AKTIENGESELLSCHAFT (DE) 1995-01-26 — — WO disclosed
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