SCHEMBL16217679

SCHEMBL16217679

c1ccc(CC2CCC3OC3C2)c(CC2CCC3OC3C2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.36
GRIK1 P39086 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
TFPI2 P48307 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
TBXA2R P21731 2/20 0.32
EED O75530 3/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL5902514 0.87 SLC6A2 (0.39) CYP2D6SLC6A2SLC6A4MEN1KMT2A
SCHEMBL5271479 0.83 CCR3 (0.47) ALDH1A1
SCHEMBL5524767 0.83 NAAA (0.37) CYP2D6SLC6A2SLC6A4MEN1KMT2A
SCHEMBL5822033 0.78 ALDH1A1 (0.31) ALDH1A1GAAMAPTHSD17B10
SCHEMBL5822613 0.78 SLC6A4 (0.33) CYP2D6SLC6A2SLC6A4MEN1KMT2A
SCHEMBL10807016 0.78 CCR3 (0.39) CYP2D6SLC6A2SLC6A4MEN1KMT2A
SCHEMBL5822036 0.77 SLC6A2 (0.33) SLC6A2SLC6A4MEN1KMT2AHTR1A
SCHEMBL16217681 0.76
SCHEMBL5822802 0.74 SLC6A4 (0.30) SLC6A4HTR1A
SCHEMBL5822799 0.74 SLC6A2 (0.33) CYP2D6SLC6A2SLC6A4HSD17B10

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-9268222-B2 Photosensitive negative resin composition, fine structure, production process of fine structure and liquid ejection head CANON KABUSHIKI KAISHA (JP) 2016-02-23 US disclosed
US-9028038-B2 Liquid discharge head CANON KABUSHIKI KAISHA (JP) 2015-05-12 US disclosed
US-20150097892-A1 LIQUID DISCHARGE HEAD CANON KABUSHIKI KAISHA (JP) 2015-04-09 US disclosed
US-20140329175-A1 PHOTOSENSITIVE NEGATIVE RESIN COMPOSITION, FINE STRUCTURE, PRODUCTION PROCESS OF FINE STRUCTURE AND LIQUID EJECTION HEAD CANON KABUSHIKI KAISHA (JP) 2014-11-06 US disclosed