SCHEMBL8653147

SCHEMBL8653147

Nc1ccc(N=Nc2ccc(N)c3ccccc23)c2ccccc12

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.80
NPC1 O15118 2/20 0.80
L3MBTL1 Q9Y468 2/20 0.80
MEN1 O00255 2/20 0.80
KMT2A Q03164 2/20 0.80
MAPK1 P28482 2/20 0.80
MAPT P10636 1/20 0.80
INSR P06213 1/20 0.57
GLO1 Q04760 2/20 0.56
SENP3 Q9H4L4 3/20 0.54
SENP2 Q9HC62 3/20 0.54
SENP1 Q9P0U3 3/20 0.54
SUMO2 P61956 2/20 0.54
SUMO1 P63165 2/20 0.54
SENP7 Q9BQF6 2/20 0.54
ALDH1A1 P00352 3/20 0.50
CYP3A4 P08684 3/20 0.50
TSHR P16473 3/20 0.50
IDO1 P14902 2/20 0.50
EP300 Q09472 2/20 0.50

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
SCHEMBL3694952 0.91 MEN1 (0.89) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL3694948 0.91 MEN1 (0.89) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL3694949 0.91 MEN1 (0.89) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL243333 0.89 MEN1 (1.00) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL31073963 0.89 MEN1 (1.00) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL15274139 0.89 MEN1 (1.00) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL243332 0.89 MEN1 (1.00) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL29362584 0.89 MEN1 (1.00) TDP1NPC1L3MBTL1MEN1KMT2A
SCHEMBL4567367 0.89 TDP1 (0.66) TDP1NPC1L3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL5846982 0.88 MEN1 (0.96) TDP1NPC1L3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5721324-A ADDITION POLYMERIZATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-02-24 US claimed
US-5721324-A ADDITION POLYMERIZATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-02-24 US disclosed
EP-0109624-A2 Process for producing shaped articles made from polyurethane-polyurea which may be cellular BASF Aktiengesellschaft (DE) 1984-05-30 EP disclosed