SCHEMBL7906100

SCHEMBL7906100

CCc1cc(C2(c3cc(CC)c(OCCO)c(CC)c3)CCCCCCC2)cc(CC)c1OCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.40
ADORA3 P0DMS8 1/20 0.35
PPARA Q07869 1/20 0.35
ESR1 P03372 3/20 0.34
ESR2 Q92731 3/20 0.34
PSMB1 P20618 1/20 0.33
PSMB5 P28074 1/20 0.33
PSMB2 P49721 1/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
S1PR1 P21453 1/20 0.32
SLC6A5 Q9Y345 2/20 0.32
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
PDE1A P54750 1/20 0.32
PDE1B Q01064 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE7A Q13946 1/20 0.32
PDE1C Q14123 1/20 0.32

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
SCHEMBL5493886 1.00 ACHE (0.40) ACHEADORA3PPARAESR1ESR2
SCHEMBL7909231 1.00 ACHE (0.40) ACHEADORA3PPARAESR1ESR2
SCHEMBL7908979 0.98 ACHE (0.38) ACHEADORA3PPARAESR1ESR2
P-Xylene SCHEMBL6570096 0.92 ACHE (0.38) ACHEADORA3PPARAESR1ESR2
SCHEMBL7909140 0.88 ACHE (0.38) ACHEADORA3PPARAESR1ESR2
SCHEMBL7908947 0.88 ACHE (0.38) ACHEADORA3PPARAESR1ESR2
SCHEMBL7909144 0.88 ACHE (0.38) ACHEADORA3PPARAESR1ESR2
SCHEMBL7907580 0.87 ACHE (0.36) ACHEESR1ESR2KMT2AMEN1
SCHEMBL7907583 0.86 ACHE (0.36) ACHEADORA3PPARAESR1ESR2
SCHEMBL7899691 0.84 ACHE (0.37) ACHEPPARAESR1ESR2PSMB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187493-B1 CHARGE GENERATING MATERIAL AND ELECTRON TRANSFER MATERIAL UNIFORMLY DISPERSED WITHIN COMPATIBLE POLYESTER BINDER; PHOTOSENSITIVITY, WEAR RESISTANCE, ADHESION TO ELECTROCONDUCTIVE SUBSTRATE KYOCERA MITA CORPORATION (JP) 2001-02-13 US disclosed
EP-0738934-A2 Electrophotosensitive material MITA INDUSTRIAL CO., LTD. (JP) 1996-10-23 EP disclosed