SCHEMBL11991029

SCHEMBL11991029

CC(F)(F)CC(F)(F)P(=O)(c1cc2ccc3cccc4ccc(c1)c2c34)c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A1 P04798 2/20 0.33
CYP1B1 Q16678 2/20 0.33
CYP1A2 P05177 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PTPN1 P18031 1/20 0.31
ERBB2 P04626 1/20 0.31
FYN P06241 1/20 0.31
MAOA P21397 1/20 0.31
ACHE P22303 1/20 0.31
AHR P35869 1/20 0.31

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
SCHEMBL11991032 0.94 MEN1 (0.34) MEN1KMT2ACYP1A2ALDH1A1HPGD
SCHEMBL11991028 0.93 MEN1 (0.32) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991030 0.88 MEN1 (0.32) MEN1KMT2AALDH1A1TSHRKDM4E
SCHEMBL11991027 0.88 MEN1 (0.36) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991021 0.84 MEN1 (0.33) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991019 0.82 ALDH1A1 (0.39) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991003 0.79 CYP1A1 (0.42) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991022 0.77 MEN1 (0.39) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991772 0.76 CYP1A1 (0.39) MEN1KMT2ACYP1A1CYP1B1CYP1A2
SCHEMBL11991769 0.73 MEN1 (0.37) MEN1KMT2ACYP1A1CYP1B1CYP1A2

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