SCHEMBL8897411

SCHEMBL8897411

C=C(C)C(=O)OCCCCCCOc1ccc(C=Cc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.57
POLB P06746 2/20 0.57
APEX1 P27695 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PTGS2 P35354 2/20 0.55
MAPT P10636 8/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
LMNA P02545 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
MAOB P27338 1/20 0.49
LSS P48449 2/20 0.48
KDM4E B2RXH2 2/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.45

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
SCHEMBL8897407 1.00 HTT (0.57) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL10333121 1.00 HTT (0.57) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL9133114 0.99 PTGS2 (0.56) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL9480426 0.96 PTGS2 (0.57) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL9480422 0.96 PTGS2 (0.57) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL9332678 0.89 POLB (0.61) HTTPOLBAPEX1TDP1MAPT
SCHEMBL10333148 0.88 MAPT (0.49) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL10397395 0.87 EPHX1 (0.47) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL10479349 0.86 PTGS2 (0.49) HTTPOLBAPEX1TDP1PTGS2
SCHEMBL10332681 0.86 PTGS2 (0.47) HTTPOLBAPEX1TDP1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670871-A Polymeric film electrooptic sensor device CORNING INCORPORATED 1997-09-23 US claimed
US-5670871-A Polymeric film electrooptic sensor device CORNING INCORPORATED 1997-09-23 US disclosed
WO-1993026088-A1 WAVEGUIDE DEVICE FOR PHASE MATCHED SECOND HARMONIC GENERATION HOECHST CELANESE CORPORATION (US) 1993-12-23 WO disclosed
US-5224196-A Waveguide device and method for phase matched second harmonic generation HOECHST CELANESE CORP. 1993-06-29 US disclosed
US-5007696-A Electro-optic channel waveguide LOCKHEED MISSILES & SPACE COMPANY, INC. (US) 1991-04-16 US disclosed
US-5006285-A Electro-optic channel waveguide LOCKHEED MISSILES & SPACE COMPANY, INC. (US) 1991-04-09 US disclosed
US-4915491-A Side chain liquid crystalline acrylic copolymers exhibiting nonlinear optical response HOECHST CELANESE CORPORATION (US) 1990-04-10 US disclosed
EP-0315894-A1 Acrylic copolymers exhibiting nonlinear optical response HOECHST CELANESE CORPORATION (US) 1989-05-17 EP disclosed
US-4822865-A TRANSPARENT LIGHT SWITCHES HOECHST CELANESE CORP. (US) 1989-04-18 US disclosed