SCHEMBL4134601

SCHEMBL4134601

C=COc1ccc(C2(c3ccc(OC=C)c(CC)c3)c3ccccc3-c3ccccc32)cc1CC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
CYP2D6 P10635 1/20 0.33
POLB P06746 1/20 0.33
PDK2 Q15119 2/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL15926113 0.94 ESR1 (0.43) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL4126295 0.90 ESR1 (0.40) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL15356197 0.87 ESR1 (0.38) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL4126313 0.85 ESR1 (0.38) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL4125755 0.84 ESR1 (0.37) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL4140256 0.83 ESR1 (0.36) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL15356196 0.82 ESR1 (0.34) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL16995002 0.82 ESR1 (0.37) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL16994999 0.82 ESR1 (0.40) ESR1ESR2MEN1KMT2ASMN1; SMN2
SCHEMBL15356189 0.82 THRB (0.46) ESR1ESR2MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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