SCHEMBL6322648

SCHEMBL6322648

C=C(C)C(=O)Oc1c(C)c(OCC)c(C2(c3c(OCC)c(C)c(OC(=O)C(=C)C)c(OCC)c3OCC)c3ccccc3-c3ccccc32)c(OCC)c1OCC

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.33
PDK2 Q15119 6/20 0.32
ALDH1A1 P00352 4/20 0.31
HPGD P15428 2/20 0.31
MAPT P10636 2/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MPI P34949 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
IDO1 P14902 1/20 0.30
TDO2 P48775 1/20 0.30
GLA P06280 1/20 0.30
KMT2A Q03164 1/20 0.30
CASP1 P29466 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
SCHEMBL6330393 0.93 ELANE (0.35) ELANEPDK2ALDH1A1HPGDMAPT
SCHEMBL6330263 0.91 PDK2 (0.34) ELANEPDK2
SCHEMBL6324392 0.88 ELANE (0.32) ELANEPDK2ALDH1A1SMN1; SMN2KDM4E
SCHEMBL6325333 0.86 ELANE (0.31) ELANEPDK2
SCHEMBL6324996 0.85 ELANE (0.30) ELANE
SCHEMBL6330760 0.84 PDK2 (0.36) ELANEPDK2ALDH1A1KMT2A
SCHEMBL6331102 0.83 RXRA (0.30)
SCHEMBL6323024 0.82 ELANE (0.35) ELANEALDH1A1MAPTESR1ESR2
SCHEMBL7074634 0.82
SCHEMBL6324942 0.82 MAPT (0.38) PDK2ALDH1A1HPGDMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050185232-A1 Volume hologram recording photosensitive composition and its use NIPPON PAINT CO., LTD. (JP) 2005-08-25 US disclosed