SCHEMBL9927289

SCHEMBL9927289

Pc1cccc2c1Oc1c(P)cccc1N2c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
CES2 O00748 1/20 0.35
ALDH1A1 P00352 1/20 0.35
BCHE P06276 1/20 0.35
CES1 P23141 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.34
MGLL Q99685 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
P2RX4 Q99571 1/20 0.30
MAOA P21397 1/20 0.30
ATM Q13315 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
SCHEMBL24858829 0.77 MGLL (0.37) GAACES2ALDH1A1BCHECES1
SCHEMBL11991098 0.73 NPSR1 (0.38) GAACES2ALDH1A1BCHECES1
SCHEMBL10154110 0.72 DRD1 (0.51) GAACES2ALDH1A1BCHECES1
SCHEMBL1573901 0.71 ALDH1A1 (0.50) GAACES2ALDH1A1BCHECES1
SCHEMBL22068219 0.71 ALDH1A1 (0.50) GAACES2ALDH1A1BCHECES1
SCHEMBL30060869 0.71 ALDH1A1 (0.50) GAACES2ALDH1A1BCHECES1
SCHEMBL1573992 0.69 P2RX4 (0.47) GAACES2ALDH1A1BCHECES1
SCHEMBL29406608 0.69 P2RX4 (0.47) GAACES2ALDH1A1BCHECES1
SCHEMBL29379993 0.69 P2RX4 (0.47) GAACES2ALDH1A1BCHECES1
SCHEMBL21415178 0.68 P2RX4 (0.37) GAACES2ALDH1A1BCHECES1

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