SCHEMBL793033

SCHEMBL793033

COc1ccccc1C=C[N+](=O)[O-]

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.73
TLR4 O00206 1/20 0.66
TLR2 O60603 1/20 0.66
ALDH1A1 P00352 5/20 0.56
LMNA P02545 5/20 0.56
MAPT P10636 5/20 0.56
MAPK1 P28482 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
HPGD P15428 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
S1PR4 O95977 1/20 0.56
ITGA4 P13612 1/20 0.56
S1PR1 P21453 1/20 0.56
TLR9 Q9NR96 1/20 0.56
HTT P42858 2/20 0.55
MITF O75030 1/20 0.55
HSP90AA1 P07900 1/20 0.55
NFE2L2 Q16236 4/20 0.54

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
SCHEMBL793032 1.00 PRMT1 (0.73) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL27394119 1.00 PRMT1 (0.73) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL3068651 0.86 PRMT1 (0.74) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL3068655 0.86 PRMT1 (0.74) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL1011169 0.85 PRMT1 (1.00) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL10466720 0.85 PRMT1 (0.72) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL10466719 0.85 PRMT1 (0.72) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL1011167 0.85 PRMT1 (1.00) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL3775942 0.83 PRMT1 (0.70) PRMT1TLR4TLR2ALDH1A1LMNA
SCHEMBL8321676 0.83 PRMT1 (0.70) PRMT1TLR4TLR2ALDH1A1LMNA

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104277072-B A kind of preparation method of (E)-2-aryl vinyl phosphate derivatives JIANGSU CHINASUN SPECIALTY PRODUCTS CO.,LTD. (CN) 2016-04-13 CN claimed
CN-104277072-A Method for preparing (E)-2-aryl vinyl phosphonate derivatives CHINASUN SPECIALTY PRODUCTS CO LTD 2015-01-14 CN claimed
CN-116041241-A Method for synthesizing pyrrole compound by solid acid catalysis 浙江工业大学 2023-05-02 CN disclosed
CN-107188771-B Chiral synthesis method of gamma-nitrophenol compound 浙江工业大学 2021-08-24 CN disclosed
CN-111848678-A Phosphorus-containing thienopyrimidine derivatives 正大天晴药业集团股份有限公司 2020-10-30 CN disclosed
EP-3625222-A1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2020-03-25 EP disclosed
WO-2018210994-A1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2018-11-22 WO disclosed
CN-107827774-A Nitrosamine compound containing two fluoro ethyls and preparation method thereof 遵义医学院 2018-03-23 CN disclosed
CN-104277072-B A kind of preparation method of (E)-2-aryl vinyl phosphate derivatives JIANGSU CHINASUN SPECIALTY PRODUCTS CO.,LTD. (CN) 2016-04-13 CN disclosed
CN-104059051-B The preparation method of three substituted-tetrahydro thiophene SOUTHWEST UNIVERSITY (CN) 2016-02-03 CN disclosed
US-8946260-B2 17α-hydroxylase/C17,20-lyase inhibitors NOVARTIS AG (CH) 2015-02-03 US disclosed
WO-1999057122-A1 3-PHENYLPYRROLE ALPHA-1 ADRENERGIC COMPOUNDS ABBOTT LABORATORIES (US) 1999-11-11 WO disclosed
EP-0923581-A1 4-SUBSTITUTED BETA-CARBOLINES AS IMMUNOMODULATORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1999-06-23 EP disclosed
EP-0833630-A4 NOVEL BENZOPYRAN COMPOUNDS AND METHODS FOR THEIR USE SUGEN INC (US) 1998-09-02 EP disclosed
US-5763470-A Benzopyran compounds and methods for their use SUGEN INC. (US) 1998-06-09 US disclosed
EP-0833630-A1 NOVEL BENZOPYRAN COMPOUNDS AND METHODS FOR THEIR USE Sugen, Inc. (US) 1998-04-08 EP disclosed
WO-1998006719-A1 4-SUBSTITUTED BETA-CARBOLINES AS IMMUNOMODULATORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1998-02-19 WO disclosed
EP-0776324-A1 ENDOTHELIN ANTAGONISTS Abbott Laboratories (US) 1997-06-04 EP disclosed
WO-1996040110-A1 NOVEL BENZOPYRAN COMPOUNDS AND METHODS FOR THEIR USE SUGEN, INC. (US) 1996-12-19 WO disclosed
WO-1996006095-A1 ENDOTHELIN ANTAGONISTS ABBOTT LABORATORIES (US) 1996-02-29 WO disclosed