SCHEMBL9018537

SCHEMBL9018537

Brc1ccc(Cc2nc3ccccc3s2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UBE2T Q9NPD8 1/20 0.54
ASIC3 Q9UHC3 1/20 0.54
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 2/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 5/20 0.47
MAPK1 P28482 1/20 0.47
HPGD P15428 1/20 0.47
CYP1A2 P05177 2/20 0.45

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
SCHEMBL1127709 0.86 UBE2T (0.61) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL28984544 0.83 KDM4E (0.56) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL30306722 0.83 PTGS1 (0.57) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL28984550 0.83 PTGS1 (0.57) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL1904314 0.83 UBE2T (0.54) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL30306697 0.83 KDM4E (0.56) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL9306082 0.83 SMN1; SMN2 (0.61) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL4319441 0.83 MAPT (0.64) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL1903062 0.83 UBE2T (0.54) UBE2TASIC3MEN1ALDH1A1KMT2A
SCHEMBL4726116 0.83 UBE2T (0.59) UBE2TASIC3MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117813294-A Cyano-substituted heteroaromatic amine derivative and organic electroluminescent device comprising the same 株式会社乐普拓 2024-04-02 CN disclosed
CN-110845439-B Method for synthesizing 2-substituted benzothiazole by one-pot method 南京工业大学 2023-04-11 CN disclosed
CN-110845439-A Method for synthesizing 2-substituted benzothiazole by one-pot method 南京工业大学 2020-02-28 CN disclosed
US-5558904-A Electroluminescent devices containing a conjugated polymer obtained via halogen precursor route chemistry XEROX CORPORATION (US) 1996-09-24 US disclosed