SCHEMBL8767208

SCHEMBL8767208

COc1ccc([C@@]23CC4C[C@@H](C[C@@](C)(C4)C2)C3)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSD11B1 P28845 2/20 0.50
ESR1 P03372 1/20 0.45
MAOB P27338 2/20 0.44
MAOA P21397 1/20 0.44
PGR P06401 4/20 0.43
ALDH1A1 P00352 2/20 0.43
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
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL16352314 0.90 LMNA (0.56) LMNASMN1; SMN2HSD11B1ESR1MAOB
SCHEMBL8766728 0.90 LMNA (0.56) LMNASMN1; SMN2HSD11B1ESR1MAOB
SCHEMBL12276579 0.84 SMN1; SMN2 (0.65) LMNASMN1; SMN2HSD11B1ESR1KMT2A
SCHEMBL12040557 0.83 LMNA (0.57) LMNASMN1; SMN2HSD11B1MAOBMAOA
SCHEMBL25458202 0.80 GRIN2D (0.64) LMNAHSD11B1PGRALDH1A1GRIN2D
SCHEMBL822923 0.79 LMNA (0.57) LMNASMN1; SMN2HSD11B1ESR1PGR
SCHEMBL31525726 0.79 MAOB (0.55) LMNASMN1; SMN2HSD11B1MAOBMAOA
SCHEMBL12936217 0.78 KMT2A (0.66) LMNASMN1; SMN2HSD11B1ALDH1A1KMT2A
SCHEMBL12780752 0.74 ESR1 (0.36) LMNASMN1; SMN2HSD11B1ESR1PGR
SCHEMBL17855983 0.73 HSD11B1 (0.44) LMNASMN1; SMN2HSD11B1ESR1MAOB

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-20120130041-A1 Transparent Polyarylene Ether Polymer With High Heat Resistance And Method For Preparing The Same IUCF-HYU (Industry-University Coperation Foundatio Hanyang University (KR) 2012-05-24 US disclosed