SCHEMBL13664622

SCHEMBL13664622

C=CC(=O)OCOc1ccc(COc2ccc(OCc3ccc(OC)c(F)c3)c(C(F)(F)F)c2C(F)(F)F)cc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
FFAR1 O14842 2/20 0.39
PPARG P37231 2/20 0.39
PPARD Q03181 2/20 0.39
PPARA Q07869 2/20 0.39
RAB9A P51151 1/20 0.39
MAPK10 P53779 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALKBH1 Q13686 1/20 0.39
ERN1 O75460 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR5 Q9H228 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37

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
SCHEMBL13668006 0.95 LMNA (0.41) LMNAHTTALDH1A1SMN1; SMN2HPGD
SCHEMBL13664623 0.82 FFAR1 (0.42) HTTALDH1A1SMN1; SMN2FFAR1PPARD
SCHEMBL13668005 0.80 MAOB (0.40) PPARGPPARDPPARA
SCHEMBL13664644 0.79 AKR1C3 (0.35)
SCHEMBL13664624 0.78 TDP1 (0.32) LMNAHTTMAPK1MEN1KMT2A
SCHEMBL13664619 0.78 MTNR1B (0.41) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL14088587 0.75 TSHR (0.39) ALDH1A1HPGDPPARAHSD17B10S1PR1
SCHEMBL13668003 0.75 MAOB (0.36) ALDH1A1SMN1; SMN2FFAR1S1PR1S1PR5
SCHEMBL12731130 0.75 ALDH1A1 (0.35) ALDH1A1FFAR1PPARGPPARD
SCHEMBL13664617 0.74 MAOB (0.37) LMNAHTTALDH1A1SMN1; SMN2MEN1

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-7597945-B2 Optical compensation film; mixture of three (meth)acrylate monomers: e.g. 2,7-bis(acryloyloxyhexyloxy-1,4-phenylenecarbonyloxy)fluorene, a bis 2-fluoroacrylate monomer, and a cyanobiphenyloxyalkanol ester of (meth)acrylic acid; hardness, heat resistance, weatherability, colorless, LC physical properties CHISSO CORPORATION (JP) 2009-10-06 US disclosed