SCHEMBL14701780

SCHEMBL14701780

Cc1cc(C2(c3ccc(OC(C)(C)C)c(C)c3)c3ccccc3Oc3ccccc32)ccc1OC(=O)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ELANE P08246 14/20 0.36
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 1/20 0.31
XBP1 P17861 1/20 0.31
KMT2A Q03164 1/20 0.31
CHEK1 O14757 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
SCHEMBL14701778 0.77 ESR1 (0.44) LMNAMAPTNPSR1ELANEESR1
SCHEMBL14700552 0.77 ALOX5 (0.41) LMNAMAPTESR1ESR2MEN1
SCHEMBL21075509 0.77 ESR1 (0.49) LMNAMAPTNPSR1ESR1ESR2
SCHEMBL15869210 0.74 ESR1 (0.56) LMNAMAPTNPSR1ESR1ESR2
SCHEMBL12346214 0.74 ESR1 (0.41) LMNAMAPTNPSR1ELANEESR1
SCHEMBL14922916 0.71 ELANE (0.40) LMNAMAPTNPSR1ELANEESR1
SCHEMBL22416789 0.70 ESR1 (0.51) LMNAMAPTESR1ESR2MEN1
SCHEMBL25065685 0.69 ELANE (0.43) MAPTELANEKMT2A
SCHEMBL823264 0.69 ESR1 (0.42) ELANEESR1ESR2
SCHEMBL18648920 0.68 ESR1 (0.41) ELANEESR1ESR2

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-20130040234-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, MANUFACTURING METHOD THEREFOR AND ELECTROPHOTOGRAPHIC DEVICE FUJI ELECTRIC CO., LTD. (JP) 2013-02-14 US disclosed