SCHEMBL8069192

SCHEMBL8069192

CCOC(C)OC1C=Cc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.34
LMNA P02545 3/20 0.33
RET P07949 1/20 0.33
HTR6 P50406 1/20 0.33
HTR2A P28223 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TP53 P04637 1/20 0.30
CHRM2 P08172 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
NFKB1 P19838 1/20 0.30
CHRM3 P20309 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 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
SCHEMBL5039115 0.81 SIGMAR1 (0.35) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL19655048 0.77 SIGMAR1 (0.34) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL4516491 0.76 RET (0.42) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL15224275 0.73 HTR6 (0.38) SIGMAR1LMNARETHTR6SMN1; SMN2
SCHEMBL5036744 0.72 RET (0.36) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL29434193 0.70 RET (0.44) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL1680359 0.70 RET (0.38) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL15224276 0.70 HTR6 (0.43) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL5036828 0.70 RET (0.41) SIGMAR1LMNARETHTR6HTR2A
SCHEMBL5031536 0.70 RET (0.35) SIGMAR1RETHTR6HTR2A

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-6127579-A REACTING AN INDANYL ETHER UNDER BASIC CONDITIONS TO GIVE A NOVEL SUBSTANCE WHICH IS THE INDENYL ETHER DERIVATIVE AND HYDROLYZING THIS TO GIVE THE 1-INDANONE ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 2000-10-03 US disclosed
EP-0968991-A1 Method of manufacturing 1-indanone ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 2000-01-05 EP disclosed