SCHEMBL4131849

SCHEMBL4131849

C=COc1ccc(C2(c3ccc(OC=C)c(C)c3)c3ccccc3-c3ccccc32)cc1C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.55
ESR2 Q92731 1/20 0.55
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 3/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
OPRK1 P41145 1/20 0.40
POLB P06746 2/20 0.33
XBP1 P17861 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CHRM5 P08912 4/20 0.33

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
SCHEMBL16994995 0.97 ESR1 (0.52) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL15356195 0.93 ESR1 (0.49) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL4125760 0.82 ESR1 (0.49) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL15926113 0.82 ESR1 (0.43) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL29849984 0.82 ESR1 (0.51) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL22215860 0.82 ESR1 (0.51) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL4134601 0.82 ESR1 (0.41) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL18415977 0.81 ESR1 (0.61) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL4137407 0.81 ESR1 (0.48) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL19563081 0.81 ESR1 (0.38) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2762503-B1 OPTICAL ELEMENT MATERIAL AND METHOD FOR PRODUCING SAME MARUZEN PETROCHEM CO LTD (JP) 2017-11-08 EP disclosed
US-9574106-B2 Optical element material and method for producing same MARUZEN PETROCHEMICAL CO., LTD. (JP) 2017-02-21 US disclosed
US-9574106-B2 Optical element material and method for producing same MARUZEN PETROCHEMICAL CO., LTD. (JP) 2017-02-21 US disclosed
US-9399693-B2 Resin composition for photoimprinting, pattern forming process and etching mask MARUZEN PETROCHEMICAL CO., LTD. (JP) 2016-07-26 US disclosed
US-9399693-B2 Resin composition for photoimprinting, pattern forming process and etching mask MARUZEN PETROCHEMICAL CO., LTD. (JP) 2016-07-26 US disclosed
US-20140287219-A1 OPTICAL ELEMENT MATERIAL AND METHOD FOR PRODUCING SAME MARUZEN PETROCHEMICAL CO., LTD. (JP) 2014-09-25 US disclosed
US-20140287219-A1 OPTICAL ELEMENT MATERIAL AND METHOD FOR PRODUCING SAME MARUZEN PETROCHEMICAL CO., LTD. (JP) 2014-09-25 US disclosed
US-20130288021-A1 RESIN COMPOSITION FOR PHOTOIMPRINTING, PATTERN FORMING PROCESS AND ETCHING MASK MARUZEN PETROCHEMICAL CO., LTD. (JP) 2013-10-31 US disclosed
US-20130288021-A1 RESIN COMPOSITION FOR PHOTOIMPRINTING, PATTERN FORMING PROCESS AND ETCHING MASK MARUZEN PETROCHEMICAL CO., LTD. (JP) 2013-10-31 US disclosed
US-20090068569-A1 Resin composition for hologram recording material, hologram recording material, and method for producing hologram recording medium NIPPON PAINT CO., LTD. 2009-03-12 US disclosed