SCHEMBL17515239

SCHEMBL17515239

CC1(C)c2ccccc2-c2cc(C=O)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLNR O43193 1/20 0.38
NR1I2 O75469 1/20 0.38
CHRM2 P08172 1/20 0.38
ADRB1 P08588 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD2 P14416 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
CHRM3 P20309 1/20 0.38
DRD1 P21728 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
OPRM1 P35372 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL3557265 0.89 PDK2 (0.41) MLNRNR1I2CHRM2ADRB1HTR1A
SCHEMBL28426241 0.82 MLNR (0.38) MLNRNR1I2CHRM2ADRB1HTR1A
SCHEMBL29588873 0.79 ALDH1A1 (0.41) ALDH1A1CYP2A6TSHRKDM4EPTGS2
SCHEMBL12934281 0.79 ALDH1A1 (0.41) ALDH1A1CYP2A6TSHRKDM4EPTGS2
SCHEMBL13805748 0.77 ALDH1A1 (0.40) MLNRNR1I2CHRM2ADRB1HTR1A
SCHEMBL1053716 0.77 ALDH1A1 (0.40) MLNRNR1I2CHRM2ADRB1HTR1A
SCHEMBL13355909 0.76 ALDH1A1 (0.39) DRD2DRD1DRD3PDK2ALDH1A1
SCHEMBL13355908 0.76 ALDH1A1 (0.39) DRD2DRD1DRD3PDK2ALDH1A1
SCHEMBL5014621 0.76 HTR2A (0.43) MLNRNR1I2CHRM2ADRB1HTR1A
SCHEMBL5062909 0.76 HTR2A (0.43) MLNRNR1I2CHRM2ADRB1HTR1A

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
CN-114369055-B Organic compound and organic electroluminescent device comprising same 武汉尚赛光电科技有限公司 2024-06-28 CN disclosed
CN-114369055-A Organic compound and organic electroluminescent device comprising same 武汉尚赛光电科技有限公司 2022-04-19 CN disclosed
EP-3183285-A1 COMPOSITIONS COMPRISING OXYGEN SUBSTITUTED BENZOCYCLOBUTENES AND DIENOPHILES, AND ELECTRONIC DEVICES CONTAINING SAME Dow Global Technologies LLC (US) 2017-06-28 EP disclosed
WO-2016026451-A1 COMPOSITIONS COMPRISING OXYGEN SUBSTITUTED BENZOCYCLOBUTENES AND DIENOPHILES, AND ELECTRONIC DEVICES CONTAINING SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2016-02-25 WO disclosed