SCHEMBL6328902

SCHEMBL6328902

C=C(C)C(=O)Oc1ccc(C2(c3ccc(OC(=O)C(=C)C)c(OC)c3OC)c3ccccc3-c3ccccc32)c(OC)c1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.37
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
PARP1 P09874 1/20 0.35
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
ITGA4 P13612 1/20 0.33
PDK2 Q15119 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 3/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
THRB P10828 1/20 0.31
MEN1 O00255 2/20 0.30
USP2 O75604 2/20 0.30
KMT2A Q03164 2/20 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
SCHEMBL31068446 0.84 PDK2 (0.36) ELANEALDH1A1MAPTPDK2SMN1; SMN2
SCHEMBL2873370 0.84 PDK2 (0.36) ELANEALDH1A1MAPTPDK2SMN1; SMN2
SCHEMBL6325063 0.84 ELANE (0.35) ELANEALDH1A1MAPTPDK2SMN1; SMN2
SCHEMBL6320914 0.82 PDK2 (0.36) ELANEALDH1A1MAPTPDK2NPC1
SCHEMBL31068454 0.82 ELANE (0.43) ELANEALDH1A1MAPTITGA4PDK2
SCHEMBL6328823 0.80 ELANE (0.38) ELANEALDH1A1MAPTITGA4PDK2
SCHEMBL7072257 0.79 PDK2 (0.34) ELANEALDH1A1MAPTITGA4PDK2
SCHEMBL6320141 0.77 PDK2 (0.34) ELANEPDK2
SCHEMBL6323470 0.77 ALOX5 (0.33) ELANEALDH1A1MAPTNPC1RAB9A
SCHEMBL6323024 0.76 ELANE (0.35) ELANEALDH1A1MAPTITGA4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10611869-B2 Curable composition and cured product AGC Inc. (JP) 2020-04-07 US disclosed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US disclosed
US-20050185232-A1 Volume hologram recording photosensitive composition and its use NIPPON PAINT CO., LTD. (JP) 2005-08-25 US disclosed
US-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed