SCHEMBL16265306

SCHEMBL16265306

C=C(C)C(=O)Oc1ccc(C(=C2CCCCC2)c2ccc(OC(=O)C(=C)C)c(OC(=O)C(=C)C)c2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.46
PGR P06401 1/20 0.46
CHRM2 P08172 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
AR P10275 1/20 0.46
CHRM1 P11229 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
ALDH1A1 P00352 3/20 0.38
RAB9A P51151 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
ELANE P08246 1/20 0.35
TOP1 P11387 2/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL16265278 0.92 ESR1 (0.52) ESR1PGRCHRM2ADORA3AR
SCHEMBL16265205 0.86 ESR1 (0.60) ESR1PGRCHRM2ADORA3AR
SCHEMBL16265308 0.83 ESR1 (0.40) ESR1PGRCHRM2ADORA3AR
SCHEMBL16265210 0.82 TSHR (0.45) ALDH1A1RAB9ATSHRKDM4EGAA
SCHEMBL16265291 0.74 RAB9A (0.38) ESR1ALDH1A1RAB9ATSHRKDM4E
SCHEMBL16265208 0.74 ESR1 (0.46) ESR1PGRCHRM2ADORA3AR
SCHEMBL16265254 0.74 ESR1 (0.44) ESR1PGRCHRM2ADORA3AR
SCHEMBL15385612 0.73 ERN1 (0.40) ADORA3ARALDH1A1RAB9ATSHR
SCHEMBL16265279 0.73 ESR1 (0.43) ESR1PGRCHRM2ADORA3AR
SCHEMBL11754333 0.72 ESR1 (0.47) ESR1PGRCHRM2ADORA3AR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139672-B2 Polymerizable compound, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-22 US disclosed
US-9139672-B2 Polymerizable compound, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-22 US disclosed
US-20140346399-A1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-11-27 US disclosed
US-20140346399-A1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-11-27 US disclosed