SCHEMBL9927352

SCHEMBL9927352

O=P(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(P(=O)(c2ccc(F)cc2)c2ccc(F)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
BCL2L1 Q07817 1/20 0.39
BAD Q92934 1/20 0.39
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
ACHE P22303 1/20 0.38
CA12 O43570 1/20 0.38
MMP2 P08253 1/20 0.38
PTPN1 P18031 1/20 0.37
LMNA P02545 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.34
IDO1 P14902 1/20 0.33
ORAI1 Q96D31 1/20 0.33
ORAI2 Q96SN7 1/20 0.33
ORAI3 Q9BRQ5 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
SCHEMBL779999 1.00 CES2 (0.39) CES2CES1BCL2L1BADCA1
Hydrogen Peroxide SCHEMBL8672187 0.94 BCL2L1 (0.46) CES2CES1BCL2L1BADCA1
SCHEMBL11991140 0.94 BCL2L1 (0.46) CES2CES1BCL2L1BADCA1
Hydrogen Peroxide SCHEMBL8672190 0.94 BCL2L1 (0.46) CES2CES1BCL2L1BADCA1
SCHEMBL1244527 0.89 LMNA (0.50) BCL2L1BADCA2LMNANPC1
SCHEMBL10635216 0.89 LMNA (0.50) BCL2L1BADCA2LMNANPC1
SCHEMBL4328356 0.87 ACHE (0.62) ACHELMNA
SCHEMBL10526220 0.87 ACHE (0.62) ACHELMNA
SCHEMBL4579901 0.87 ESR1 (0.45) CES2CES1BCL2L1BADCA1
SCHEMBL4577933 0.87 ESR1 (0.45) CES2CES1BCL2L1BADCA1

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