SCHEMBL218117

SCHEMBL218117

CC(C)(C)[Si](OC[C@@H](O)CO)(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.42
KDM4E B2RXH2 2/20 0.42
AGTR1 P30556 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
AR P10275 6/20 0.37
CYP2D6 P10635 1/20 0.36
VDR P11473 1/20 0.36
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ADRB2 P07550 2/20 0.35
ADRB1 P08588 1/20 0.35

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
SCHEMBL2531862 1.00 CYP1A2 (0.42) CYP1A2KDM4EAGTR1LMNATSHR
SCHEMBL21873649 1.00 CYP1A2 (0.42) CYP1A2KDM4EAGTR1LMNATSHR
SCHEMBL24312400 0.93 CYP2D6 (0.38) CYP1A2KDM4EAGTR1LMNAKMT2A
SCHEMBL7155286 0.92 CYP2D6 (0.37) CYP1A2KDM4EAGTR1LMNAKMT2A
SCHEMBL6158503 0.89 CYP3A4 (0.37) KDM4EAGTR1LMNATSHRMEN1
SCHEMBL31200933 0.87 MAPT (0.44) CYP1A2KDM4EAGTR1LMNAKMT2A
SCHEMBL15209484 0.87 ALOX15 (0.44) TSHRKMT2ACYP2D6CYP3A4HTT
SCHEMBL1363054 0.87 CYP2D6 (0.35) CYP1A2KDM4EAGTR1LMNAKMT2A
SCHEMBL15209482 0.87 ALOX15 (0.44) TSHRKMT2ACYP2D6CYP3A4HTT
SCHEMBL6156817 0.87 AR (0.41) LMNAKMT2AARCYP2D6CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110678447-B Modified nucleic acid monomer compounds and oligonucleotide analogues 卫材R&D管理有限公司 2023-12-12 CN disclosed
EP-3643706-B1 MODIFIED NUCLEIC ACID MONOMERS AND OLIGONUCLEIC ACID ANALOGUES, WITH HIGH BIOLOGICAL STABILITY AND TARGET GENE SILENCING ACTIVITY, FOR USE IN THERAPY AND DIAGNOSIS OF CANCER AND VIRAL DISEASES EISAI R&D MAN CO LTD (JP) 2023-11-15 EP disclosed
US-11208429-B2 Modified nucleic acid monomer compound and oligonucleic acid analog EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-12-28 US disclosed
EP-3643706-A9 MODIFIED NUCLEIC ACID MONOMER COMPOUND AND OLIGONUCLEIC ACID ANALOG Eisai R&D Management Co., Ltd. (JP) 2020-09-23 EP disclosed
US-20200216488-A1 MODIFIED NUCLEIC ACID MONOMER COMPOUND AND OLIGONUCLEIC ACID ANALOG EISAI R&D MANAGEMENT CO., LTD. (JP) 2020-07-09 US disclosed
EP-3643706-A1 MODIFIED NUCLEIC ACID MONOMER COMPOUND AND OLIGONUCLEIC ACID ANALOG Eisai R&D Management Co., Ltd. (JP) 2020-04-29 EP disclosed
CN-110678447-A Modified nucleic acid monomer compounds and oligonucleotide analogs 卫材R&D管理有限公司 2020-01-10 CN disclosed
US-8304409-B2 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NICOX S.A. (FR) 2012-11-06 US disclosed
US-8222277-B2 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NICOX S.A. (FR) 2012-07-17 US disclosed
US-8088762-B2 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NICOX S.A. (FR) 2012-01-03 US disclosed
US-20110098253-A1 Nitrosated Nonsteroidal Antiinflammatory Compounds, Compositions and Methods of Use NICOX S.A. (IT) 2011-04-28 US disclosed
US-7883714-B2 (2R)-2,3-bis(nitrooxy)propyl(2S)-2(6-methoxy(2-naphthyl)propanoate, used for treating inflammation, pain and fever; gastrointestinal disorders; wound healing agents; preventing gastrointestinal, renal and/or respiratory toxicities; side effect reduction; kits NICOX S.A. (FR) 2011-02-08 US disclosed
US-7754772-B2 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NICOX, S.A. (FR) 2010-07-13 US disclosed
US-20100137291-A1 NITROSATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE NICOX SA (FR) 2010-06-03 US disclosed
US-20100093671-A1 NITROSATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE NICOX SA (FR) 2010-04-15 US disclosed
US-20100093708-A1 NITROSATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE NICOX SA (FR) 2010-04-15 US disclosed
US-7163958-B2 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NITROMED INC. (US) 2007-01-16 US disclosed
US-20050222243-A1 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NITROMED, INC. (US) 2005-10-06 US disclosed
US-20040024057-A1 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use related applications NITROMED, INC. 2004-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100093708-A1 NITROSATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE NOS2, NOS1, NOS3 CYP1A2 229/4885KDM4E 4390/4885AGTR1 1007/4885
US-20200216488-A1 MODIFIED NUCLEIC ACID MONOMER COMPOUND AND OLIGONUCLEIC ACID ANALOG POLRMT, DERA, PCNA CYP1A2 4729/4885KDM4E 3391/4885AGTR1 1505/4885
US-20110098253-A1 Nitrosated Nonsteroidal Antiinflammatory Compounds, Compositions and Methods of Use NOS2, NOS1, NOS3 CYP1A2 199/4885KDM4E 4443/4885AGTR1 1357/4885
US-20040024057-A1 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use related applications NOS2, NOS1, NOS3 CYP1A2 230/4885KDM4E 4225/4885AGTR1 1099/4885
US-11208429-B2 Modified nucleic acid monomer compound and oligonucleic acid analog POLRMT, DERA, PCNA CYP1A2 4729/4885KDM4E 3391/4885AGTR1 1505/4885
US-20100093671-A1 NITROSATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE NOS2, NOS1, NOS3 CYP1A2 229/4885KDM4E 4390/4885AGTR1 1007/4885
US-20100137291-A1 NITROSATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE NOS2, NOS1, NOS3 CYP1A2 229/4885KDM4E 4390/4885AGTR1 1007/4885
US-20050222243-A1 Nitrosated nonsteroidal antiinflammatory compounds, compositions and methods of use NOS2, NOS1, NOS3 CYP1A2 229/4885KDM4E 4390/4885AGTR1 1007/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.