SCHEMBL9927317

SCHEMBL9927317

O=P(c1ccc(-c2cccc(-c3ccccc3)c2)cc1)(c1ccc(-c2cccc(-c3ccccc3)c2)cc1)c1ccc(-c2cccc(-c3ccccc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.48
ACMSD Q8TDX5 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ESR1 P03372 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPN5 P54829 1/20 0.46
GGPS1 O95749 2/20 0.44
MAOA P21397 1/20 0.44
HDAC8 Q9BY41 2/20 0.44
LMNA P02545 2/20 0.44
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CA12 O43570 1/20 0.43
NOTUM Q6P988 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC2 Q92769 1/20 0.43
ALOX5 P09917 1/20 0.43
FDPS P14324 1/20 0.43
MMP8 P22894 1/20 0.43

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
SCHEMBL18780695 1.00 KMO (0.48) KMOACMSDMEN1KMT2AESR1
SCHEMBL17451971 0.98 LMNA (0.47) KMOACMSDMEN1KMT2AESR1
SCHEMBL22174891 0.91 HDAC8 (0.46) KMOACMSDMEN1KMT2AESR1
SCHEMBL19444838 0.91 HDAC8 (0.46) KMOACMSDMEN1KMT2APTPN1
SCHEMBL14339275 0.90 ALDH1A1 (0.53) MEN1KMT2APTPN5LMNACA2
SCHEMBL14339266 0.90 ALDH1A1 (0.53) MEN1KMT2APTPN5LMNACA2
SCHEMBL11145592 0.90 ALDH1A1 (0.53) MEN1KMT2APTPN5LMNACA2
SCHEMBL17426603 0.90 ESR1 (0.45) KMOACMSDMEN1KMT2AESR1
SCHEMBL22174847 0.88 HDAC8 (0.47) KMOACMSDMEN1KMT2AESR1
SCHEMBL11991101 0.88 HDAC8 (0.47) KMOACMSDMEN1KMT2AESR1

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