SCHEMBL1480100

SCHEMBL1480100

Cc1ccccc1-c1cccc2c1C(=O)c1ccccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.50
SMN1; SMN2 Q16637 6/20 0.50
ALDH1A1 P00352 6/20 0.50
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
LMNA P02545 5/20 0.50
KDM4E B2RXH2 5/20 0.50
MAPK1 P28482 4/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
MAOA P21397 3/20 0.50
APAF1 O14727 2/20 0.50
TDP2 O95551 2/20 0.50
HTT P42858 2/20 0.50
CES2 O00748 1/20 0.50
TERT O14746 1/20 0.50
PLIN1 O60240 1/20 0.50
S1PR4 O95977 1/20 0.50
PLA2G1B P04054 1/20 0.50
BCHE P06276 1/20 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
SCHEMBL19146551 0.94 ALDH1A1 (0.56) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29908547 0.89 SMN1; SMN2 (0.55) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL3976848 0.89 SMN1; SMN2 (0.55) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
Water SCHEMBL27388116 0.87 SMN1; SMN2 (0.53) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2993336 0.84 SMN1; SMN2 (0.59) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL10885242 0.82 ALDH1A1 (0.53) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL224650 0.80 ALDH1A1 (0.66) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL30580334 0.80 ALDH1A1 (0.66) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL19299612 0.80 S100A4 (0.58) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5010110 0.79 MEN1 (0.67) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A

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
WO-2017144150-A2 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-08-31 WO disclosed
US-8293856-B2 Process for preparing olefin polymer using mixed catalyst MITSUI CHEMICALS, INC. (JP) 2012-10-23 US disclosed
US-20110077369-A1 PROCESS FOR PREPARING OLEFIN POLYMER USING MIXED CATALYST MITSU CHEMICALS, INC. 2011-03-31 US disclosed