SCHEMBL9629210

SCHEMBL9629210

O=C(O)C#Cc1ccccc1.[CsH]

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.57
APP P05067 1/20 0.52
VCP P55072 1/20 0.52
FFAR1 O14842 7/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
HSP90AA1 P07900 2/20 0.50
AGTR1 P30556 1/20 0.50
PAX8 Q06710 1/20 0.50
TLR9 Q9NR96 1/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
OPRK1 P41145 1/20 0.46
PAM P19021 1/20 0.45
FFAR4 Q5NUL3 1/20 0.44
POLB P06746 1/20 0.43
NLRP3 Q96P20 1/20 0.43

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
SCHEMBL68968 0.97 NPSR1 (0.59) NPSR1APPVCPFFAR1NPC1
Benzene SCHEMBL28174766 0.97 NPSR1 (0.59) NPSR1APPVCPFFAR1NPC1
SCHEMBL28226784 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1
SCHEMBL6552221 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1
Ammonia Solution, Strong SCHEMBL20473394 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1
SCHEMBL6553632 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1
SCHEMBL6554023 0.95 NPSR1 (0.63) NPSR1APPVCPFFAR1NPC1
SCHEMBL2281388 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1
SCHEMBL7611739 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1
Hydrochloric Acid SCHEMBL1569398 0.95 NPSR1 (0.57) NPSR1APPVCPFFAR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905361-B2 Base proliferating agent, and base-reactive resin composition containing said base proliferating agent NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2024-02-20 US disclosed
US-20220332886-A1 Base Proliferating Agent, and Base-Reactive Resin Composition Containing Said Base Proliferating Agent NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2022-10-20 US disclosed
US-11401370-B2 Base proliferating agent, and base-reactive resin composition containing said base proliferating agent NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2022-08-02 US disclosed
US-20200407487-A1 Base Proliferating Agent, and Base-Reactive Resin Composition Containing Said Base Proliferating Agent NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2020-12-31 US disclosed
CN-109563353-A Resin combination 东丽株式会社 2019-04-02 CN disclosed
CN-101263429-B pattern forming method using film-forming composition TOKYO OHKA KOGYO CO.,LTD. (JP) 2011-12-28 CN disclosed
CN-102257432-A Cationic radiation curable compositions AGFA GRAPHICS NV 2011-11-23 CN disclosed
CN-101137620-B Alkali proliferating agent and alkali-reactive curable composition SEKISUI CHEMICAL CO LTD 2011-05-25 CN disclosed
CN-101263429-A Film-forming composition, pattern-forming method using the same, and three-dimensional mold TOKYO OHKA KOGYO CO LTD (JP) 2008-09-10 CN disclosed
CN-101137620-A Alkali proliferating agent and alkali-reactive curable composition SEKISUI CHEMICAL CO LTD (JP) 2008-03-05 CN disclosed
EP-0192272-B1 COLOR LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1992-05-27 EP 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-20200407487-A1 Base Proliferating Agent, and Base-Reactive Resin Composition Containing Said Base Proliferating Agent PCNA, MKI67, POLR1A NPSR1 1572/4885APP 3176/4885VCP 1998/4885
US-11905361-B2 Base proliferating agent, and base-reactive resin composition containing said base proliferating agent PCNA, MKI67, POLR1A NPSR1 1703/4885APP 3057/4885VCP 1782/4885
US-11401370-B2 Base proliferating agent, and base-reactive resin composition containing said base proliferating agent PCNA, MKI67, POLR1A NPSR1 1703/4885APP 3057/4885VCP 1782/4885
US-20220332886-A1 Base Proliferating Agent, and Base-Reactive Resin Composition Containing Said Base Proliferating Agent PCNA, MKI67, POLR1A NPSR1 1703/4885APP 3057/4885VCP 1782/4885

“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.