SCHEMBL22430188

SCHEMBL22430188

C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(CCCCCCOC(=O)C=C)cc3)cc2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.45
MAPT P10636 2/20 0.41
HTT P42858 3/20 0.40
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PLA2G4B P0C869 1/20 0.39
CYP3A4 P08684 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
THRA P10827 3/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL14000686 1.00 THRB (0.45) THRBMAPTHTTKMT2ANPC1
SCHEMBL15149978 0.98 THRB (0.45) THRBMAPTHTTKMT2ANPC1
SCHEMBL14749471 0.97 THRB (0.47) THRBMAPTKMT2ACYP3A4ALDH1A1
SCHEMBL19600626 0.96 THRB (0.52) THRBMAPTKMT2ANPC1LMNA
SCHEMBL17549441 0.95 THRB (0.53) THRBMAPTKMT2ANPC1LMNA
SCHEMBL24937951 0.95 THRB (0.43) THRBMAPTHTTKMT2ANPC1
SCHEMBL16674100 0.95 HTT (0.44) THRBMAPTHTTKMT2ANPC1
SCHEMBL17721435 0.95 HTT (0.44) THRBMAPTHTTKMT2ANPC1
SCHEMBL9110786 0.95 HTT (0.44) THRBMAPTHTTKMT2ANPC1
SCHEMBL9106264 0.95 HTT (0.44) THRBMAPTHTTKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11346989-B2 Mesogen polarizer HOYA OPTICAL LABS OF AMERICA, INC. (US) 2022-05-31 US disclosed
US-20200292740-A1 Mesogen Polarizer VISION EASE, LP (US) 2020-09-17 US disclosed