SCHEMBL824480

SCHEMBL824480

CCCCC(=O)Oc1ccc(C(C)(C)CC(C)(C)C)cc1C(C)c1cc(C(C)(C)CC(C)(C)C)ccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.40
RORC P51449 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
RECQL P46063 1/20 0.38
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 1/20 0.36
HIF1A Q16665 1/20 0.36
MDH1 P40925 3/20 0.35
MDH2 P40926 3/20 0.35
ESR1 P03372 2/20 0.35
TOP2A P11388 2/20 0.35
SHBG P04278 1/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
PGR P06401 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
AR P10275 1/20 0.34
MAPT P10636 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
SCHEMBL841393 0.83 RORC (0.41) RORCMEN1KMT2ACYP3A4CYP2D6
SCHEMBL824502 0.81 CYP3A4 (0.37) RORCMEN1KMT2ACYP3A4CYP2D6
SCHEMBL824547 0.77 RORC (0.47) ALOX15RORCMEN1KMT2AKDM4E
SCHEMBL824536 0.76 ALOX15 (0.47) ALOX15MEN1KMT2AKDM4ERECQL
SCHEMBL824511 0.74 ALOX15 (0.47) ALOX15CYP3A4TOP2A
SCHEMBL11240232 0.70 CYP3A4 (0.43) RORCMEN1KMT2ACYP3A4CYP2D6
SCHEMBL15625191 0.70 TYR (0.45) RORCMEN1KMT2ACYP3A4CYP2D6
SCHEMBL51093 0.70 RORC (0.57) ALOX15RORCMEN1KMT2ACYP3A4
SCHEMBL18998976 0.69 SMN1; SMN2 (0.39) MEN1KMT2AKDM4ECYP3A4CYP2D6
SCHEMBL15547801 0.69 ALOX15 (0.55) ALOX15MEN1KMT2AKDM4ERECQL

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
US-8142864-B2 Cellulose ester pellets, cellulose ester film, manufacturing method of cellulose ester film, polarizing plate, and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2012-03-27 US disclosed
US-20100047480-A1 CELLULOSE ESTER PELLETS, CELLULOSE ESTER FILM, MANUFACTURING METHOD OF CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY C/O KONICA MINOLTA OPTO, INC. (JP) 2010-02-25 US disclosed