SCHEMBL9927149

SCHEMBL9927149

O=P(c1cc(-c2ccccc2)cc(-c2ccccc2)c1)(c1ccc2ccc3cccc4ccc1c2c34)c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.44
ERBB2 P04626 1/20 0.44
FYN P06241 1/20 0.44
MAOA P21397 1/20 0.44
ACHE P22303 1/20 0.44
AHR P35869 1/20 0.44
ALDH1A1 P00352 5/20 0.39
HPGD P15428 5/20 0.39
HSD17B10 Q99714 4/20 0.39
THRB P10828 1/20 0.39
CYP19A1 P11511 1/20 0.36
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 2/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL11990905 0.91 CYP1A2 (0.44) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL9927274 0.88 CYP1A2 (0.42) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL9927238 0.85 CYP1A2 (0.42) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL29662001 0.84 CYP1A2 (0.47) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2384413 0.84 CYP1A2 (0.47) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL11962348 0.84 CYP1A2 (0.41) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL17880381 0.83 CYP1A2 (0.38) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL18116635 0.82 CYP1A2 (0.37) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL18116634 0.82 CYP1A2 (0.37) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2901666 0.81 CYP1A2 (0.47) CYP1A2ERBB2FYNMAOAACHE

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