SCHEMBL6324382

SCHEMBL6324382

C=C(C)C(=O)Oc1c(OCCC)cc(C2(c3cc(OCCC)c(OC(=O)C(=C)C)c(CCC)c3OCCC)c3ccccc3-c3ccccc32)c(OCCC)c1CCC

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.34
LTB4R Q15722 5/20 0.31
LTB4R2 Q9NPC1 4/20 0.31
ADORA3 P0DMS8 1/20 0.31
PTGER1 P34995 1/20 0.31
CYSLTR2 Q9NS75 4/20 0.31
CYSLTR1 Q9Y271 4/20 0.31
MDM2 Q00987 1/20 0.31
FFAR4 Q5NUL3 1/20 0.30
TNF P01375 1/20 0.30
CYP2C9 P11712 1/20 0.30
IDO1 P14902 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
SCHEMBL6324793 0.93 PDK2 (0.34) PDK2PTGER1MDM2FFAR4TNF
SCHEMBL6323480 0.91 TSHR (0.33) PDK2
SCHEMBL6323519 0.90 PDK2 (0.36) PDK2ADORA3PTGER1MDM2FFAR4
SCHEMBL6324549 0.88 PDK2 (0.35) PDK2PTGER1MDM2FFAR4TNF
SCHEMBL6322382 0.86 PDK2 (0.33) PDK2
SCHEMBL6325368 0.86 ALOX5 (0.36) PDK2ADORA3
SCHEMBL6328897 0.82 TSHR (0.34) PDK2
SCHEMBL4123427 0.80 PDK2 (0.37) PDK2ADORA3MDM2
SCHEMBL6320914 0.80 PDK2 (0.36) PDK2PTGER1TNF
SCHEMBL2866535 0.79 TSHR (0.36) PDK2

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