SCHEMBL5489157

SCHEMBL5489157

Nc1ccc2cccc3c2c1C=CC3N

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
CYP1B1 Q16678 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL29012925 0.98 ALDH1A1 (0.32) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Ammonia Solution, Strong SCHEMBL8085239 0.98 ALDH1A1 (0.32) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Hydroxyamine SCHEMBL29210814 0.97 ALDH1A1 (0.31) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
SCHEMBL900144 0.95 ALDH1A1 (0.30) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
Acetonitrile SCHEMBL29013766 0.91
Alcohol SCHEMBL29044093 0.91
Hydrochloric Acid SCHEMBL28198085 0.85 CYP3A4 (0.33) ALDH1A1CYP3A4HSD17B10
SCHEMBL10870531 0.81 ALDH1A1 (0.32) ALDH1A1CYP1A1CYP1A2CYP3A4HPGD
SCHEMBL28097865 0.79 DHFR (0.36) ALDH1A1HSD17B10
SCHEMBL5534355 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3917991-A1 POLY(ETHERIMIDE), METHOD FOR THE MANUFACTURE THEREOF, AND ARTICLES COMPRISING THE POLY(ETHERIMIDE) SHPP Global Technologies B.V. (NL) 2021-12-08 EP claimed
WO-2020160205-A1 POLY(ETHERIMIDE), METHOD FOR THE MANUFACTURE THEREOF, AND ARTICLES COMPRISING THE POLY(ETHERIMIDE) SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2020-08-06 WO claimed
US-20190245177-A1 POLYIMIDE WEB SEPARATOR FOR USE IN AN ELECTROCHEMICAL CELL DU PONT (US) 2019-08-08 US claimed
US-20150325831-A1 POLYIMIDE WEB SEPARATOR FOR USE IN AN ELECTROCHEMICAL CELL DUPONT SAFETY & CONSTRUCTION, INC. 2015-11-12 US claimed
US-20190245177-A1 POLYIMIDE WEB SEPARATOR FOR USE IN AN ELECTROCHEMICAL CELL DU PONT (US) 2019-08-08 US disclosed
CN-109565015-A Diaphragm, product and its manufacturing method 沙特基础工业全球技术有限公司 2019-04-02 CN disclosed
CN-108699349-A Coloring composition, ink for inkjet recording, inkjet recording method, and ink cartridge for inkjet printer 富士胶片株式会社 2018-10-23 CN disclosed
US-20150325831-A1 POLYIMIDE WEB SEPARATOR FOR USE IN AN ELECTROCHEMICAL CELL DUPONT SAFETY & CONSTRUCTION, INC. 2015-11-12 US disclosed
EP-1797947-B1 Encapsulated active material with reduced formaldehyde potential INT FLAVORS & FRAGRANCES INC (US) 2013-03-27 EP disclosed
EP-2545988-A2 Encapsulated active material with reduced formaldehyde potential International Flavors & Fragrances, Inc. (US) 2013-01-16 EP disclosed
CN-101665637-B Ink and ink set for inkjet recording FUJI PHOTO FILM CO LTD 2012-07-11 CN disclosed
CN-101397427-B Ink and ink set for inkjet recording FUJI PHOTO FILM CO LTD 2011-04-13 CN disclosed
CN-100577751-C Ink and ink set for inkjet recording FUJI PHOTO FILM CO LTD 2010-01-06 CN disclosed
CN-101397427-A Ink and ink set for inkjet recording FUJIFILM CORP (JP) 2009-04-01 CN disclosed
US-20070138671-A1 Encapsulated active material with reduced formaldehyde potential INTERNATIONAL FLAVORS & FRAGRANCES INC. 2007-06-21 US disclosed
US-20070138674-A1 ENCAPSULATED ACTIVE MATERIAL WITH REDUCED FORMALDEHYDE POTENTIAL INTERNATIONAL FLAVORS & FRAGRANCES INC. 2007-06-21 US disclosed
EP-1797947-A2 Encapsulated active material with reduced formaldehyde potential INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) 2007-06-20 EP disclosed
CN-1303161-C Novel anthrapyridone compounds, water-base magenta ink compositions, and ink-jet recording process NIPPON KAYAKU KK (JP) 2007-03-07 CN disclosed
CN-1871317-A Ink and ink set for inkjet recording FUJI PHOTO FILM CO LTD (JP) 2006-11-29 CN disclosed
CN-1558933-A Anthrapyridone compound, water-based magenta ink composition, and ink-jet recording method 日本化药株式会社 2004-12-29 CN disclosed