SCHEMBL4728822

SCHEMBL4728822

COc1cccc(N2C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 5/20 0.67
NR1H2 P55055 1/20 0.67
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
ALDH1A1 P00352 2/20 0.64
HPGD P15428 2/20 0.64
MGLL Q99685 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
GRM5 P41594 1/20 0.60
SCN2A Q99250 2/20 0.58
MAPT P10636 3/20 0.54
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
GAA P10253 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL30758624 1.00 NR1H3 (0.67) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL12231557 0.90 MEN1 (0.61) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL13084672 0.88 MGLL (0.62) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL12639229 0.87 MGLL (0.57) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL11615606 0.85 NR1H3 (0.61) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL17326658 0.84 MGLL (0.54) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL14731789 0.84 MEN1 (0.61) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL10013240 0.83 ALDH1A1 (0.65) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL725608 0.82 NR1H3 (0.67) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL5658435 0.82 ALDH1A1 (0.63) NR1H3NR1H2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117466799-A Preparation method of N-substituted phthalimide compound 西北师范大学 2024-01-30 CN disclosed
CN-110330526-B Green synthesis method of thiophosphite 成都理工大学 2021-11-26 CN disclosed
WO-2008029168-A2 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2008-03-13 WO disclosed
EP-0384895-B1 2- Or 3-fluorane-dicarboxylic imides, process for their preparation and their use in recording materials CIBA GEIGY AG (CH) 1995-12-06 EP disclosed
US-5066814-A 2-DICARBOXIMIDEFLUORANE OR 3-DICARBOXIMIDEFLUORANE COMPOUNDS CIBA-GEIGY CORPORATION (US) 1991-11-19 US disclosed
EP-0384895-A2 2- Or 3-fluorane-dicarboxylic imides, process for their preparation and their use in recording materials CIBA-GEIGY AG (CH) 1990-08-29 EP disclosed