SCHEMBL11991023

SCHEMBL11991023

CC(F)(F)P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
ESR1 P03372 1/20 0.45
ALDH1A1 P00352 5/20 0.44
GAA P10253 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PKM P14618 1/20 0.44
CFTR P13569 1/20 0.43
KDM4E B2RXH2 1/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 1/20 0.42
CA5A P35218 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
PTPN1 P18031 1/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
PGK1 P00558 1/20 0.37

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
SCHEMBL11991025 0.85 PTPN1 (0.45) TSHRESR1ALDH1A1GAAMEN1
SCHEMBL11991022 0.81 MEN1 (0.39) TSHRESR1ALDH1A1GAAMEN1
SCHEMBL11228761 0.80 TSHR (0.54) TSHRESR1ALDH1A1GAAMEN1
SCHEMBL9777478 0.80 CA2 (0.46) TSHRESR1ALDH1A1GAAMEN1
SCHEMBL11991034 0.77 PTPN1 (0.49) ESR1MEN1KMT2APTPN1L3MBTL1
SCHEMBL11991771 0.76 KDM4E (0.42) TSHRESR1ALDH1A1GAAMEN1
SCHEMBL6050587 0.76 ALDH1A1 (0.59) TSHRESR1ALDH1A1GAAMEN1
SCHEMBL11034944 0.74 PTPN1 (0.50) TSHRESR1ALDH1A1MEN1KMT2A
SCHEMBL19190002 0.73 KDM4E (0.38) TSHRESR1GAAMEN1KMT2A
SCHEMBL11035324 0.73 PTPN1 (0.54) TSHRESR1ALDH1A1MEN1KMT2A

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 1 patent. 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