SCHEMBL11991022

SCHEMBL11991022

CC(F)(F)P(=O)(c1ccccc1)c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
PTPRC P08575 1/20 0.35
CYP1A2 P05177 2/20 0.35
ERBB2 P04626 1/20 0.35
FYN P06241 1/20 0.35
MAOA P21397 1/20 0.35
ACHE P22303 1/20 0.35
AHR P35869 1/20 0.35
PTPN1 P18031 4/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 3/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP1A1 P04798 2/20 0.34
CYP1B1 Q16678 2/20 0.34
HPGD P15428 2/20 0.34
CYP3A4 P08684 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PGK1 P00558 2/20 0.34
PGK2 P07205 2/20 0.34

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
SCHEMBL11991019 0.94 ALDH1A1 (0.39) MEN1KMT2APTPRCCYP1A2ERBB2
SCHEMBL11991025 0.85 PTPN1 (0.45) MEN1KMT2APTPN1TSHRALDH1A1
SCHEMBL11991775 0.84 MEN1 (0.39) MEN1KMT2APTPRCCYP1A2ERBB2
SCHEMBL11991032 0.84 MEN1 (0.34) MEN1KMT2APTPRCCYP1A2ERBB2
SCHEMBL11991030 0.81 MEN1 (0.32) MEN1KMT2APTPRCTSHRALDH1A1
SCHEMBL11991023 0.81 TSHR (0.45) MEN1KMT2APTPN1NPSR1TSHR
SCHEMBL11991003 0.80 CYP1A1 (0.42) MEN1KMT2APTPRCCYP1A2ERBB2
SCHEMBL11991034 0.80 PTPN1 (0.49) MEN1KMT2ACYP1A2PTPN1ESR1
SCHEMBL11991714 0.80 MEN1 (0.35) MEN1KMT2APTPRCCYP1A2ERBB2
SCHEMBL11991716 0.80 MEN1 (0.35) MEN1KMT2APTPRCCYP1A2ERBB2

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