SCHEMBL22562499

SCHEMBL22562499

FC(F)(F)c1cc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1-c1cccc(-c2ccccc2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.36
MEN1 O00255 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
TP53 P04637 1/20 0.32
BACE1 P56817 1/20 0.32
ACHE P22303 2/20 0.32
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
RAC2 P15153 1/20 0.31
RAC3 P60763 1/20 0.31
CDC42 P60953 1/20 0.31
RAC1 P63000 1/20 0.31
ESR1 P03372 1/20 0.31
S1PR1 P21453 2/20 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
SCHEMBL22562502 1.00 CYP11B2 (0.36) CYP11B2MEN1RAB9AKMT2AL3MBTL1
SCHEMBL22562500 0.94 CYP11B2 (0.36) CYP11B2MEN1RAB9AKMT2AL3MBTL1
SCHEMBL22562306 0.93 CYP11B2 (0.35) CYP11B2MEN1RAB9AKMT2AL3MBTL1
SCHEMBL22562292 0.90 CYP11B2 (0.39) CYP11B2MEN1RAB9AKMT2ABACE1
SCHEMBL22562418 0.89 KIF11 (0.36) CYP11B2MEN1RAB9AKMT2AATM
SCHEMBL22562592 0.88 PTGDR2 (0.35) CYP11B2MEN1RAB9AKMT2AL3MBTL1
SCHEMBL22562458 0.88 TRPV1 (0.35) CYP11B2MEN1RAB9AKMT2AL3MBTL1
SCHEMBL22562409 0.87 ACP1 (0.39) CYP11B2L3MBTL1KDM4EHPGDALDH1A1
SCHEMBL22562307 0.86 CYP11B2 (0.35) CYP11B2MEN1RAB9AKMT2AL3MBTL1
SCHEMBL22562415 0.86 CYP11B2 (0.38) CYP11B2MEN1RAB9AKMT2AACHE

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
EP-3418278-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP disclosed