SCHEMBL27358659

SCHEMBL27358659

CCCCC(CC)Cn1nnc(-c2ccccc2C)c1CN

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.39
▸ IDO1 P14902 2/20 0.36
▸ TDO2 P48775 2/20 0.36
▸ ALDH1A1 P00352 5/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ GAA P10253 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NCOA3 Q9Y6Q9 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ TLR8 Q9NR97 1/20 0.33
▸ TP53 P04637 1/20 0.32

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
SCHEMBL27636024 0.80 SLC9A1 (0.47) DPP4IDO1TDO2ALDH1A1MAPT
SCHEMBL27636059 0.80 SLC9A1 (0.47) DPP4IDO1TDO2ALDH1A1MAPT
SCHEMBL27657025 0.80 SLC9A1 (0.47) DPP4IDO1TDO2ALDH1A1MAPT
SCHEMBL3501385 0.71 ALDH1A1 (0.34) IDO1TDO2ALDH1A1KDM4EMEN1
SCHEMBL29924005 0.71 GRM2 (0.46) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL31702792 0.69 SLC9A1 (0.61) ALDH1A1MAPTTP53TDP1SLC9A1
SCHEMBL21834057 0.68 GRM2 (0.43) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL570804 0.67 ALDH1A1 (0.32) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL27261064 0.65 ALDH1A1 (0.33) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL27742917 0.65 ALDH1A1 (0.33) ALDH1A1KDM4EGAAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104662137-B Lubricant compositions comprising acyclic hindered amines 巴斯夫欧洲公司 2017-09-29 — — CN disclosed
CN-104662137-A Lubricant compositions comprising acyclic hindered amines BASF SE 2015-05-27 — — CN disclosed
CN-1675341-A Engine oils comprising lead corrosion-inhibitors CIBA SC HOLDING AG (CH) 2005-09-28 — — CN disclosed
CN-1074013-C 3-arylbenzofuranones as stabilisers and its use CIBA SPECIALTY CHEMIALS HOLDIN (CH) 2001-10-31 — — CN disclosed
CN-1041415-C 3-arylbenzofuranone stabilizers and uses thereof CIBA GEIGY AG (CH) 1998-12-30 — — CN disclosed
CN-1191229-A 3-arylbenzofuranones as stabilisers and its use CIBA GEIGY AG (CH) 1998-08-26 — — CN disclosed
CN-1106809-A 3-arylbenzofuranone stabilizers CIBA GEIGY AG (CH) 1995-08-16 — — CN disclosed
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