SCHEMBL453815

SCHEMBL453815

CCN(CC)CCOC(=O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.71
CYP2D6 P10635 2/20 0.71
MAOA P21397 1/20 0.71
HTR3A P46098 1/20 0.71
HRH3 Q9Y5N1 1/20 0.71
BLM P54132 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
LMNA P02545 4/20 0.68
SCN1A P35498 3/20 0.68
SCN2A Q99250 3/20 0.68
SCN3A Q9NY46 3/20 0.68
SMN1; SMN2 Q16637 4/20 0.65
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
ALDH1A1 P00352 2/20 0.63
ATM Q13315 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.60
TDP1 Q9NUW8 1/20 0.59

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
Hydrochloric Acid SCHEMBL30061329 0.98 BLM (0.72) TSHRCYP2D6MAOAHTR3AHRH3
Acetic Acid SCHEMBL28346366 0.97 TSHR (0.68) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL10334843 0.89 TSHR (0.58) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL502025 0.89 TDP1 (0.68) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL28853482 0.88 CYP2D6 (0.74) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL17361142 0.87 TDP1 (0.67) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL12748125 0.85 TSHR (0.58) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL11148968 0.85 LMNA (0.65) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL8489298 0.85 TSHR (0.74) TSHRCYP2D6MAOAHTR3AHRH3
SCHEMBL24178227 0.84 LMNA (0.63) TSHRCYP2D6MAOAHTR3AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3786619-B1 COMPOUNDS FOR LABELING AMINE-CONTAINING COMPOUNDS, AND THEIR USE AGILENT TECHNOLOGIES INC (US) 2022-06-22 EP disclosed
US-10947349-B2 Shape-preserving polymeric replication of biological matter NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2021-03-16 US disclosed
CN-111190328-A Photosensitive coloring composition, black matrix, coloring spacer, image display device and pigment dispersion liquid 三菱化学株式会社 2020-05-22 CN disclosed
US-20200115507-A1 SHAPE-PRESERVING POLYMERIC REPLICATION OF BIOLOGICAL MATTER NAT TECH & ENG SOLUTIONS SANDIA LLC (US) 2020-04-16 US disclosed
CN-105556390-B Photosensitive coloring composition, black matrix, coloring spacer, image display device and pigment dispersion liquid 三菱化学株式会社 2020-02-28 CN disclosed
EP-3363645-B1 PRETREATMENT OF UV CURED INK UNDER-LAYERS XEROX CORP (US) 2019-10-23 EP disclosed
CN-110003123-A For treating the PGI2 receptor modulators of prostacyclin (PGI2) receptor associate disorder 艾尼纳制药公司 2019-07-12 CN disclosed
CN-104262267-B For treating the PGI2 receptor modulators of prostacyclin (PGI2) receptor associate disorder 艾尼纳制药公司 2019-02-26 CN disclosed
EP-3375621-A2 TWO COMPONENT INK JETTABLE PRIMER AND INCORPORATION OF ADHESION PROMOTER TO THE INK FOR PRINTING ONTO 3D OBJECTS Xerox Corporation (US) 2018-09-19 EP disclosed
EP-3363645-A1 PRETREATMENT OF UV CURED INK UNDER-LAYERS Xerox Corporation (US) 2018-08-22 EP disclosed
EP-0539030-B1 Optical fibre coatings and their production ZENECA LTD (GB) 1996-11-20 EP disclosed
US-5416880-A Polyurethane-acrylate ZENECA LIMITED (GB) 1995-05-16 US disclosed
EP-0539030-A1 Optical fibre coatings and their production ZENECA LIMITED (GB) 1993-04-28 EP disclosed
US-5042907-A Hollow microstructures in radiation curable coating IMPERIAL CHEMICAL INDUSTRIES (GB) 1991-08-27 US disclosed
EP-0260842-B1 COATING COMPOSITIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-07-24 EP disclosed
US-4908297-A Photocurable optical glass protective coating comprising polyurethane and ethylenically unsaturated monomer IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-03-13 US disclosed
EP-0345968-A2 Coated optical fibres BICC Public Limited Company (GB) 1989-12-13 EP disclosed
EP-0260842-A2 Coating compositions IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-03-23 EP disclosed
EP-0002625-B1 PHOTOCURABLE COMPOSITIONS, PHOTOACTIVATOR- PHOTOINITIATOR COMBINATIONS USEFUL THEREIN AND METHOD OF MAKING CURED PLASTICS COMPOSITIONS THEREFROM WARD BLENKINSOP AND COMPANY LIMITED (GB) 1982-05-12 EP disclosed
EP-0002625-A1 Photocurable compositions, photoactivator- photoinitiator combinations useful therein and method of making cured plastics compositions therefrom WARD BLENKINSOP AND COMPANY LIMITED (GB) 1979-06-27 EP disclosed