SCHEMBL19089847

SCHEMBL19089847

FC(F)(F)SOc1ccc(C23CC4CC(C2)CC(c2ccc(OSC(F)(F)F)cc2)(C4)C3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.44
PGR P06401 4/20 0.42
ALDH1A1 P00352 4/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
LMNA P02545 5/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 2/20 0.38
RAD52 P43351 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
HSD11B1 P28845 1/20 0.36

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
SCHEMBL19090020 0.90 MEN1 (0.49) ALDH1A1LMNAMEN1KMT2AL3MBTL1
SCHEMBL19089846 0.76 PGR (0.42) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL16352314 0.75 LMNA (0.56) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL8766728 0.75 LMNA (0.56) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL17042804 0.71 PGR (0.55) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL2710493 0.71 ALDH1A1 (0.64) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL25012069 0.70 ESR1 (0.46) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL12276579 0.70 SMN1; SMN2 (0.65) ESR1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL649556 0.69 ESR1 (0.60) ESR1PGRALDH1A1GRIN2DGRIN3B
SCHEMBL2708459 0.69 ALDH1A1 (0.77) ESR1PGRALDH1A1GRIN2DGRIN3B

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
WO-2017116168-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 머티어리얼사이언스 주식회사 2017-07-06 WO disclosed