SCHEMBL9927291

SCHEMBL9927291

CC1(C)c2cccc(P)c2-c2c(P)cccc21

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.34
DRD1 P21728 2/20 0.33
PDK2 Q15119 3/20 0.32
PDK4 Q16654 2/20 0.32
PDK1 Q15118 1/20 0.31
PDK3 Q15120 1/20 0.31

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
SCHEMBL30291735 0.77 DRD1 (0.49) HTR2ADRD1
SCHEMBL9927296 0.77 DRD1 (0.49) HTR2ADRD1
SCHEMBL28527151 0.76 HTR2A (0.35) HTR2ADRD1PDK2PDK4PDK1
SCHEMBL28413388 0.72 PDK2 (0.40) HTR2ADRD1PDK2PDK4
SCHEMBL29828278 0.72 PDK2 (0.40) HTR2ADRD1PDK2PDK4
SCHEMBL1627657 0.70 HTR2A (0.48) HTR2ADRD1PDK2PDK4
SCHEMBL29392540 0.70 HTR2A (0.48) HTR2ADRD1PDK2PDK4
SCHEMBL15074809 0.69 DRD1 (0.42) HTR2ADRD1
SCHEMBL6036510 0.69 PTPRC (0.42) PDK2PDK4
Ammonia Solution, Strong SCHEMBL11465690 0.67 HTR2A (0.46) HTR2ADRD1PDK2PDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed
US-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 US disclosed
EP-2463929-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL USING SAME Mitsubishi Chemical Corporation (JP) 2012-06-13 EP disclosed