SCHEMBL13668287

SCHEMBL13668287

CC(=O)c1c(C)cc(C2(c3cc(C)c(C(C)=O)c(C)c3)c3ccccc3-c3ccccc32)cc1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.57
▸ ESR2 Q92731 1/20 0.57
▸ MAPT P10636 6/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ LMNA P02545 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ PDK2 Q15119 5/20 0.40
▸ POLB P06746 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ THRB P10828 1/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ MITF O75030 1/20 0.36
▸ APAF1 O14727 1/20 0.35

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
SCHEMBL38651231 0.87 ESR1 (0.57) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL13668290 0.82 ESR1 (0.44) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL13668288 0.82 ESR1 (0.44) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL29378579 0.79 ESR1 (0.69) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL515744 0.79 ESR1 (0.69) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL30806212 0.79 ESR1 (0.69) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL2044448 0.75 ESR1 (0.59) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL29579662 0.75 ESR1 (0.59) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL17791453 0.75 ESR1 (0.48) ESR1ESR2MAPTKMT2ALMNA
SCHEMBL18386004 0.75 ESR1 (0.63) ESR1ESR2MAPTKMT2ALMNA

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-7608309-B2 Resin composition, film and image display device utilizing the resin composition FUJIFILM CORPORATION (JP) 2009-10-27 — — US disclosed
US-7608309-B2 Resin composition, film and image display device utilizing the resin composition FUJIFILM CORPORATION (JP) 2009-10-27 — — US disclosed
Send feedback