SCHEMBL6328897

SCHEMBL6328897

C=C(C)C(=O)Oc1c(OCC)cc(C2(c3cc(OCC)c(OC(=O)C(=C)C)c(CC)c3OCC)c3ccccc3-c3ccccc32)c(OCC)c1CC

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.34
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
GLA P06280 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
PDK2 Q15119 3/20 0.32
NPC1 O15118 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
SLC2A1 P11166 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ELANE P08246 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL6323480 0.92 TSHR (0.33) TSHRMAPTTP53GLAL3MBTL1
SCHEMBL2866535 0.90 TSHR (0.36) TSHRMAPTTP53GLAL3MBTL1
SCHEMBL6324793 0.90 PDK2 (0.34) TP53PDK2ELANEALDH1A1SMN1; SMN2
SCHEMBL6324942 0.88 MAPT (0.38) TSHRMAPTTP53GLAL3MBTL1
SCHEMBL6323470 0.86 ALOX5 (0.33) TSHRMAPTNPC1ELANEALDH1A1
SCHEMBL4951714 0.85 ESR1 (0.36) TSHRMAPTTP53GLAL3MBTL1
SCHEMBL6324392 0.85 ELANE (0.32) PDK2KDM4EELANEALDH1A1SMN1; SMN2
SCHEMBL6324382 0.82 PDK2 (0.34) PDK2
SCHEMBL2873370 0.80 PDK2 (0.36) TSHRMAPTTP53GLAL3MBTL1
SCHEMBL31068446 0.80 PDK2 (0.36) TSHRMAPTTP53GLAL3MBTL1

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