SCHEMBL20100727

SCHEMBL20100727

Fc1ccc2c(c1)c1cc(F)ccc1n2-c1ccc(-c2ccc(-n3c4ccc(F)cc4c4cc(F)ccc43)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.45
JAK3 P52333 1/20 0.45
CYP1A2 P05177 3/20 0.40
METAP2 P50579 3/20 0.40
NR3C1 P04150 2/20 0.38
PIK3CA P42336 2/20 0.37
MTOR P42345 1/20 0.37
KDM4E B2RXH2 2/20 0.36
PMM2 O15305 1/20 0.36
G6PD P11413 1/20 0.36
MPI P34949 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
ALDH1A1 P00352 1/20 0.36
USP14 P54578 1/20 0.36
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PGR P06401 1/20 0.35
PIK3CD O00329 1/20 0.35

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
SCHEMBL12495830 0.87 JAK2 (0.44) JAK2JAK3CYP1A2METAP2NR3C1
SCHEMBL263310 0.85 ACHE (0.43) JAK2JAK3CYP1A2METAP2PIK3CA
SCHEMBL9881171 0.84 JAK2 (0.43) JAK2JAK3CYP1A2METAP2KDM4E
SCHEMBL15926018 0.83 NR3C1 (0.54) JAK2JAK3NR3C1PIK3CAMTOR
SCHEMBL13319870 0.83 JAK2 (0.35) JAK2JAK3CYP1A2METAP2NR3C1
SCHEMBL262808 0.83 JAK2 (0.44) JAK2JAK3CYP1A2METAP2NR3C1
SCHEMBL13141882 0.82 JAK2 (0.42) JAK2JAK3CYP1A2METAP2USP14
SCHEMBL263017 0.82 ACHE (0.43) JAK2JAK3CYP1A2METAP2PIK3CA
SCHEMBL13319848 0.81 JAK2 (0.36) JAK2JAK3CYP1A2METAP2NR3C1
SCHEMBL20706822 0.81 L3MBTL1 (0.58) JAK2JAK3CYP1A2METAP2NR3C1

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-20180122587-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed
US-20180122587-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed