SCHEMBL9927349

SCHEMBL9927349

O=P(c1ccc(C(F)(F)F)cc1)(c1ccc(C(F)(F)F)cc1)c1ccc2c(ccc3cc(P(=O)(c4ccc(C(F)(F)F)cc4)c4ccc(C(F)(F)F)cc4)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.37
P2RY14 Q15391 1/20 0.37
PTPN1 P18031 4/20 0.37
KIF11 P52732 5/20 0.35
MPL P40238 1/20 0.35
PARP1 P09874 1/20 0.35
UTRN P46939 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
MMP2 P08253 1/20 0.34
ACP3 P15309 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ESR1 P03372 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
SCHEMBL11991138 0.92 KIF11 (0.37) SLC6A2P2RY14KIF11UTRNCA1
SCHEMBL11991777 0.89 PTPN1 (0.47) PTPN1KIF11UTRNCES2CES1
SCHEMBL6204533 0.82 KIF11 (0.48) KIF11CES2CES1CA12CA1
SCHEMBL11991724 0.82 KIF11 (0.48) KIF11CES2CES1CA12CA1
SCHEMBL11991131 0.81 PTPN1 (0.41) PTPN1KIF11UTRNCA1
SCHEMBL11991735 0.81 KIF11 (0.42) KIF11ACP3
SCHEMBL11991725 0.81 KIF11 (0.42) KIF11ACP3
SCHEMBL11991139 0.79 DAO (0.33) UTRNESR1
SCHEMBL11991723 0.79 KIF11 (0.43) KIF11CES2CES1CA12CA1
SCHEMBL11991746 0.79 EPM2A (0.36) SLC6A2P2RY14PTPN1KIF11PARP1

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 2 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
EP-2463929-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL USING SAME Mitsubishi Chemical Corporation (JP) 2012-06-13 EP disclosed