SCHEMBL548316

SCHEMBL548316

N#CC(C(N)=O)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 2/20 0.47
MAPK1 P28482 2/20 0.47
XBP1 P17861 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 3/20 0.46
POLB P06746 2/20 0.46
CYP2C19 P33261 2/20 0.46
RECQL P46063 2/20 0.46
CYP3A4 P08684 1/20 0.46
PARP1 P09874 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MCL1 Q07820 2/20 0.46
GAA P10253 1/20 0.42

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
SCHEMBL25514874 0.85 MAPT (0.50) ALDH1A1MAPTLMNAMAPK1XBP1
SCHEMBL269364 0.83 ALDH1A1 (0.50) ALDH1A1MAPTLMNAMAPK1XBP1
Water SCHEMBL11778081 0.83 ALDH1A1 (0.50) ALDH1A1MAPTLMNAMAPK1XBP1
SCHEMBL10595234 0.82 ALDH1A1 (0.49) ALDH1A1MAPTLMNAMAPK1XBP1
SCHEMBL29896987 0.81 GABRA1 (0.50) ALDH1A1MAPTLMNAMAPK1XBP1
Ethylene SCHEMBL28481468 0.80 ALDH1A1 (0.47) ALDH1A1MAPTLMNAMAPK1XBP1
SCHEMBL10061925 0.80 ALDH1A1 (0.51) ALDH1A1MAPTLMNAMAPK1XBP1
SCHEMBL2139192 0.80 ALDH1A1 (0.47) ALDH1A1MAPTLMNAMAPK1XBP1
Ethane SCHEMBL5679245 0.80 ALDH1A1 (0.51) ALDH1A1MAPTLMNAMAPK1XBP1
SCHEMBL30530599 0.77 ALDH1A1 (0.45) ALDH1A1MAPTLMNAMAPK1XBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114456088-A Method for purifying etoricine related impurities 宜都市华阳化工有限责任公司 2022-05-10 CN claimed
CN-109305928-A A kind of preparation method of high-quality sun-screening agent Octocrilene 安徽圣诺贝化学科技有限公司 2019-02-05 CN claimed
US-20110014140-A1 PROCESS FOR THE MANUFACTURE OF SUBSTITUTED 2-CYANO CINNAMIC ESTERS DSM IP ASSETS B.V. 2011-01-20 US claimed
US-20100048937-A1 PROCESS FOR THE MANUFACTURE OF SUBSTITUTED 2-CYANO CINNAMIC ESTERS DSM IP ASSETS B.V. (NL) 2010-02-25 US claimed
EP-2125707-A1 PROCESS FOR THE MANUFACTURE OF SUBSTITUTED 2-CYANO CINNAMIC ESTERS DSM IP Assets B.V. (NL) 2009-12-02 EP claimed
WO-2008089920-A1 PROCESS FOR THE MANUFACTURE OF SUBSTITUTED 2-CYANO CINNAMIC ESTERS DSM IP ASSETS B.V. (NL) 2008-07-31 WO claimed
US-6291586-B2 Polymeric films that contain a polymeric matrix and the absorbing material are used as the top layer of multilayer retroreflective sheetings and conformable marking sheets; resists blooming and migration 3M INNOVATIVE PROPERTIES COMPANY 2001-09-18 US claimed
US-20010007885-A1 AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBERS FOR POLYURETHANES AND POLYUREAS MINNESOTA MINING AND MANUFACTURING COMPANY 2001-07-12 US claimed
US-6150440-A A POLYMERIC FILM COMPRISING A POLYOLEFIN MODIFIED BY HYDROGEN-BONDING WITH AN AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBING COMPOUND 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-11-21 US claimed
CN-112321458-B Preparation method of sunscreen intermediate etoricine 宿迁科思化学有限公司 2023-04-07 CN disclosed
CN-114456088-A Method for purifying etoricine related impurities 宜都市华阳化工有限责任公司 2022-05-10 CN disclosed
CN-114456088-A Method for purifying etoricine related impurities 宜都市华阳化工有限责任公司 2022-05-10 CN disclosed
CN-110256289-B Preparation method of ultraviolet absorbent UV-3030 威海金威化学工业有限责任公司 2022-04-22 CN disclosed
CN-109232317-B Preparation method of ultraviolet absorbent etoriciline 黄冈美丰化工科技有限公司 2021-06-25 CN disclosed
US-6150440-A A POLYMERIC FILM COMPRISING A POLYOLEFIN MODIFIED BY HYDROGEN-BONDING WITH AN AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBING COMPOUND 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-11-21 US disclosed
EP-1025157-A1 AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBERS FOR POLYURETHANES AND POLYUREAS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-08-09 EP disclosed
US-5994431-A Amide functional ultraviolet light absorbers for polyolefins 3M INNOVATIVE PROPERTIES COMPANY (US) 1999-11-30 US disclosed
WO-1999023151-A1 AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBERS FOR POLYURETHANES AND POLYUREAS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-05-14 WO disclosed
EP-0896605-A1 AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBERS FOR POLYOLEFINS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-02-17 EP disclosed
WO-1997042261-A1 AMIDE FUNCTIONAL ULTRAVIOLET LIGHT ABSORBERS FOR POLYOLEFINS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-11-13 WO 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 (2 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-20100048937-A1 PROCESS FOR THE MANUFACTURE OF SUBSTITUTED 2-CYANO CINNAMIC ESTERS COASY, MCCC2, CES2 ALDH1A1 672/4885MAPT 3651/4885LMNA 639/4885
US-20110014140-A1 PROCESS FOR THE MANUFACTURE OF SUBSTITUTED 2-CYANO CINNAMIC ESTERS COASY, MCCC2, CES2 ALDH1A1 693/4885MAPT 3887/4885LMNA 747/4885

“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.