SCHEMBL28233679

SCHEMBL28233679

COc1cc(-c2cc(N)n(C)n2)cc(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ LMNA P02545 1/20 0.54
▸ POLB P06746 2/20 0.53
▸ TLR8 Q9NR97 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ FYN P06241 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PIK3CD O00329 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ HCK P08631 1/20 0.43
▸ SRC P12931 1/20 0.43

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
SCHEMBL28614010 0.81 MAPT (0.51) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL28234723 0.79 TLR8 (0.55) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL2763737 0.79 TLR8 (0.45) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL1915201 0.79 MEN1 (0.51) MAPTMEN1KMT2ALMNAGAA
SCHEMBL2764180 0.78 TLR8 (0.44) MAPTMEN1KMT2ALMNAPOLB
Hydrochloric Acid SCHEMBL9123032 0.77 CA1 (0.51) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL28233689 0.76 LMNA (0.57) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL28233778 0.75 MEN1 (0.62) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL28234764 0.74 PIK3CD (0.42) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL2765451 0.74 HSD17B10 (0.49) MAPTMEN1KMT2ALMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108409663-B Microtubule inhibitors, methods of preparation and uses thereof 成都威斯克生物医药有限公司 2021-09-03 — — CN disclosed
CN-108409663-A Microtubule inhibitors and its preparation method and application 四川大学 2018-08-17 — — CN disclosed
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