SCHEMBL3450609

SCHEMBL3450609

CCCC(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)(C1CC(C)(C)N(C)C(C)(C)C1)C(C(=O)O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.36
MAPT P10636 5/20 0.36
KMT2A Q03164 4/20 0.36
TSHR P16473 4/20 0.36
MEN1 O00255 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
MAPK1 P28482 2/20 0.36
BLM P54132 2/20 0.36
ATM Q13315 2/20 0.36
HIF1A Q16665 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
USP2 O75604 1/20 0.36
CYP2D6 P10635 1/20 0.36
KDM4E B2RXH2 4/20 0.34
LMNA P02545 2/20 0.34
ALOX15 P16050 2/20 0.34
GMNN O75496 1/20 0.34
GABBR2 O75899 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL29198693 0.82 ALDH1A1 (0.33) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL7212084 0.81 GAA (0.37) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL29001332 0.81 GAA (0.36) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL313286 0.80 ALDH1A1 (0.36) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL20291762 0.80 ALDH1A1 (0.40) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL223324 0.79 ALDH1A1 (0.34) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL28556085 0.79 ALDH1A1 (0.43) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL7757931 0.79 ALDH1A1 (0.34) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL1263506 0.78 ALDH1A1 (0.36) ALDH1A1MAPTKMT2ATSHRMEN1
SCHEMBL697946 0.78 HMGCR (0.36) ALDH1A1MAPTKMT2ATSHRMEN1

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-110621738-B Cyclic olefin resin composition 宝理塑料株式会社 2020-08-25 CN disclosed
CN-107407755-B Laminated film, liquid crystal display, touch panel, and organic EL display using the same 东丽株式会社 2020-06-05 CN disclosed
CN-110621738-A Cyclic olefin resin composition 宝理塑料株式会社 2019-12-27 CN disclosed
EP-1680712-B1 PHOTOCURABLE COMPOSITION FOR PRODUCING CURED ARTICLES HAVING HIGH CLARITY AND IMPROVED MECHANICAL PROPERTIES 3D SYSTEMS INC (US) 2016-01-20 EP disclosed
US-7820275-B2 Photocurable composition for producing cured articles having high clarity and improved mechanical properties HUNTSMAN ADVANCED MATERIALS AMERICAS LLC (US) 2010-10-26 US disclosed
US-20080182078-A1 Photocurable Composition For Producing Cured Articles Having High Clarity And Improved Mechanical Properties HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (US) 2008-07-31 US disclosed