SCHEMBL9927204

SCHEMBL9927204

O=c1c2cc3c(=O)n(P(=O)(c4ccccc4)c4ccccc4)c(=O)c3cc2c(=O)n1P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ CA5A P35218 1/20 0.38
▸ CFTR P13569 1/20 0.34
▸ ALDH1A1 P00352 5/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ALPG P10696 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ NPY1R P25929 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ NPY2R P49146 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32

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
SCHEMBL23431347 0.72 NPSR1 (0.44) GAAKDM4EPOLBCA2CA4
SCHEMBL11991117 0.72 CA2 (0.39) GAAKDM4ECA2CA4CA5A
SCHEMBL12792049 0.71 NPSR1 (0.40) KDM4EPOLBCA2CA4CA5A
SCHEMBL28889116 0.68 NR4A2 (0.41) —
SCHEMBL17449861 0.67 KIF11 (0.44) GAAALDH1A1NPSR1L3MBTL1HTT
SCHEMBL12792062 0.67 NPSR1 (0.40) KDM4EPOLBCA2CA4CA5A
SCHEMBL23911727 0.64 KDM4E (0.46) KDM4EPOLBALDH1A1NPSR1L3MBTL1
SCHEMBL13310390 0.64 MAPK1 (0.74) GAAKDM4EPOLBCA2ALDH1A1
SCHEMBL5543989 0.64 TSHR (0.45) GAACA2CA4CA5ACFTR
SCHEMBL29136506 0.64 PARL (0.44) GAACA2CA4CA5ACFTR

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
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