SCHEMBL2013766

SCHEMBL2013766

COCCOCCOCCOC(=O)CC#N

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.35
ADORA2A P29274 1/20 0.35
MCL1 Q07820 3/20 0.33
ABCB11 O95342 1/20 0.33
CYP3A4 P08684 1/20 0.33
ADRA2B P18089 1/20 0.33
OPRD1 P41143 1/20 0.33
SCN5A Q14524 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 1/20 0.32
APP P05067 3/20 0.32
CA2 P00918 1/20 0.31
DGKA P23743 1/20 0.31

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
SCHEMBL11287855 1.00 TSHR (0.35) TSHRADORA2AMCL1ABCB11CYP3A4
SCHEMBL755188 0.94 TSHR (0.38) TSHRADORA2AMCL1ALDH1A1HSD17B10
SCHEMBL3785372 0.90 MCL1 (0.39) TSHRMCL1ALDH1A1TP53HIF1A
SCHEMBL13557224 0.90 MCL1 (0.39) TSHRMCL1ALDH1A1TP53HIF1A
SCHEMBL31235624 0.85 ALDH1A1 (0.33) TSHRMCL1ALDH1A1
SCHEMBL31235634 0.85 ALDH1A1 (0.33) TSHRMCL1ALDH1A1
SCHEMBL3783247 0.85 ALDH1A1 (0.50) TSHRMCL1ALDH1A1TP53HIF1A
SCHEMBL28716408 0.85 ALDH1A1 (0.50) TSHRMCL1ALDH1A1TP53HIF1A
SCHEMBL10901082 0.85 DGKA (0.38) TSHRMCL1ALDH1A1TP53HIF1A
SCHEMBL6890414 0.83 MCL1 (0.43) MCL1DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024203772-A1 METHOD FOR PRODUCING ALPHA-CYANOACRYLATE 東亞合成株式会社 2024-10-03 WO disclosed
CN-114269716-A 2-cyanoacrylate compound and adhesive composition 东亚合成株式会社 2022-04-01 CN disclosed
US-10029982-B2 Light absorptive compound, polymer composition containing the compound, polymer film, and cured layer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-07-24 US disclosed
US-20170315137-A1 AMYLOID BINDING AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-11-02 US disclosed
US-20170315137-A1 AMYLOID BINDING AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-11-02 US disclosed
US-20170183304-A1 LIGHT ABSORPTIVE COMPOUND, POLYMER COMPOSITION CONTAINING THE COMPOUND, POLYMER FILM, AND CURED LAYER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-29 US disclosed
US-9551722-B2 Amyloid binding agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-01-24 US disclosed
US-9551722-B2 Amyloid binding agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-01-24 US disclosed
US-20150177262-A1 AMYLOID BINDING AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-06-25 US disclosed
US-20150177262-A1 AMYLOID BINDING AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-06-25 US disclosed
EP-2509940-B1 AMYLOID BINDING AGENTS UNIV CALIFORNIA (US) 2015-06-10 EP disclosed
US-8940918-B2 Amyloid binding agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-01-27 US disclosed
US-8940918-B2 Amyloid binding agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-01-27 US disclosed
US-20120302603-A1 AMYLOID BINDING AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-29 US disclosed
EP-2509940-A2 AMYLOID BINDING AGENTS The Regents of the University of California (US) 2012-10-17 EP disclosed
WO-2011072257-A2 AMYLOID BINDING AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-06-16 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 (4 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-20120302603-A1 AMYLOID BINDING AGENTS APP, APBA1, PSEN1 TSHR 4647/4885ADORA2A 2185/4885MCL1 3176/4885
US-20170315137-A1 AMYLOID BINDING AGENTS APBA1, APP, PSEN1 TSHR 4666/4885ADORA2A 2641/4885MCL1 3629/4885
US-20170183304-A1 LIGHT ABSORPTIVE COMPOUND, POLYMER COMPOSITION CONTAINING THE COMPOUND, POLYMER FILM, AND CURED LAYER MLN, MLEC, VIP TSHR 4449/4885ADORA2A 3424/4885MCL1 3801/4885
US-10029982-B2 Light absorptive compound, polymer composition containing the compound, polymer film, and cured layer MLN, MLEC, VIP TSHR 4449/4885ADORA2A 3424/4885MCL1 3801/4885

“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.