SCHEMBL12679255

SCHEMBL12679255

CC(C)(C)c1cc2c(c(C(C)(C)C)c1)OC(=O)C2c1ccc(OCCOC(=O)CCCCC(=O)OCCOc2ccc(C3C(=O)Oc4c3cc(C(C)(C)C)cc4C(C)(C)C)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 1/20 0.35
ALDH2 P05091 2/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
HPGD P15428 1/20 0.33
GABBR2 O75899 1/20 0.32
GABBR1 Q9UBS5 1/20 0.32
PPARG P37231 3/20 0.32
FFAR1 O14842 3/20 0.32
PPARD Q03181 2/20 0.32
BRD4 O60885 1/20 0.31
PPARA Q07869 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL29413921 0.95 DGKA (0.37) ALDH2MAOAMAOBESR1ESR2
SCHEMBL39389 0.95 DGKA (0.37) ALDH2MAOAMAOBESR1ESR2
SCHEMBL21176407 0.95 DGKA (0.37) ALDH2MAOAMAOBESR1ESR2
SCHEMBL13525823 0.95 ALDH2 (0.35) MEN1KMT2AMAPTALDH2POLB
SCHEMBL29880580 0.95 DGKA (0.37) ALDH2MAOAMAOBESR1ESR2
SCHEMBL14175644 0.95 ALDH2 (0.34) MEN1KMT2AMAPTALDH2POLB
SCHEMBL20610187 0.94 ALDH2 (0.35) MEN1KMT2AMAPTALDH2POLB
SCHEMBL21596653 0.94 ALDH2 (0.35) MEN1KMT2AMAPTALDH2POLB
SCHEMBL30172510 0.94 ALDH2 (0.35) MEN1KMT2AMAPTALDH2POLB
SCHEMBL18497009 0.94 ALDH2 (0.35) MEN1KMT2AMAPTALDH2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8274625-B2 Cellulose ester film, method for production of cellulose ester film, and protective film for polarizing plate, polarizing plate and liquid crystal display device each using the cellulose ester film KONICA MINOLTA OPTO, INC. (JP) 2012-09-25 US disclosed