SCHEMBL8835461

SCHEMBL8835461

C=CC(=O)Oc1ccc(C(C)=C(C)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.56
THRB P10828 2/20 0.54
KMT2A Q03164 1/20 0.50
AKT1 P31749 1/20 0.46
PARP10 Q53GL7 1/20 0.45
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ESR1 P03372 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL2583966 0.93 THRB (0.61) ELANETHRBKMT2AESR1RAB9A
SCHEMBL28271336 0.86 ELANE (0.50) ELANETHRBKMT2AAKT1PARP10
SCHEMBL39494 0.86 ELANE (0.65) ELANETHRBKMT2ANPC1
SCHEMBL8835784 0.83 ELANE (0.47) ELANETHRBKMT2AAKT1PARP10
SCHEMBL8836269 0.83 ELANE (0.47) ELANETHRBKMT2AAKT1PARP10
SCHEMBL1249514 0.83 F2 (0.59) ELANETHRBKMT2AAKT1PARP10
SCHEMBL4908371 0.82 KMT2A (0.61) THRBKMT2AAKT1PARP10RAB9A
SCHEMBL8835900 0.82 ESR1 (0.58) ELANETHRBKMT2AESR1SMN1; SMN2
SCHEMBL25437130 0.82 THRB (0.51) ELANETHRBKMT2AAKT1
SCHEMBL898885 0.82 MAPT (0.57) ELANETHRBKMT2ANPSR1NPC1

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-5674576-A A LIGHT MODULATING LAYER COMPOSED OF LIQUID CRYSTAL AND HIGH POLYMER RESIN IS SANDWHICHED BETWEEN TWO SUBSTRATES HAVING ELECTRODE LAYERS, MONOMERS ARE OF(METH)ACRYLOYL COMPOUNDS WITH STIBENE OR (METH)ACRYLOYL WITH DIOXANE OR DIOXOLANES NEC CORPORATION (JP) 1997-10-07 US disclosed