SCHEMBL497349

SCHEMBL497349

N#CCCOP(=O)(O)OCCC#N

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.34
P2RY2 P41231 1/20 0.34
P2RY4 P51582 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
BTN3A1 O00481 1/20 0.32
TSHR P16473 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
SCHEMBL16579313 0.91 P2RY14 (0.32) P2RY14P2RY2P2RY4
SCHEMBL2030636 0.89 ACHE (0.38) ALDH1A1TDP1BTN3A1TSHR
SCHEMBL2032723 0.89 LPAR3 (0.35) P2RY14P2RY2P2RY4BTN3A1TSHR
SCHEMBL18291794 0.87 BTN3A1 (0.32) P2RY14P2RY2P2RY4BTN3A1
SCHEMBL29285248 0.87 P2RY14 (0.32) P2RY14P2RY2P2RY4
2-Cyanoethyl Diphosphate SCHEMBL3369031 0.87 BTN3A1 (0.48) P2RY14P2RY2P2RY4TDP1BTN3A1
SCHEMBL29285250 0.87 P2RY14 (0.32) P2RY14P2RY2P2RY4
SCHEMBL21902088 0.86 CYP3A4 (0.47) TSHR
SCHEMBL22652 0.85
Water SCHEMBL6908198 0.85 LPAR3 (0.41) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118726541-A Oligonucleotide fluorescent probe and method for detecting environmental DNA by using same 青岛聚点儿科技有限公司 2024-10-01 CN claimed
CN-118324810-A Method for removing molybdate generated in AMPPD process 成都傲科新技术有限责任公司 2024-07-12 CN claimed
CN-119569609-B Method and device for recycling 3-hydroxypropionitrile in wastewater 山东海科创新研究院有限公司 2025-05-13 CN disclosed
CN-119774820-A Method for recycling phosphate compounds in wastewater and device used by method 山东海科创新研究院有限公司 2025-04-08 CN disclosed
CN-119569609-A Method and device for recycling 3-hydroxypropionitrile in wastewater 山东海科创新研究院有限公司 2025-03-07 CN disclosed
CN-118726541-A Oligonucleotide fluorescent probe and method for detecting environmental DNA by using same 青岛聚点儿科技有限公司 2024-10-01 CN disclosed
CN-118324810-A Method for removing molybdate generated in AMPPD process 成都傲科新技术有限责任公司 2024-07-12 CN disclosed
CN-118324810-A Method for removing molybdate generated in AMPPD process 成都傲科新技术有限责任公司 2024-07-12 CN disclosed
US-11866754-B2 Trinucleotide mRNA cap analogs MODERNATX, INC. (US) 2024-01-09 US disclosed
CN-117164619-A Preparation method of tri (2-cyanoethyl) phosphate 山东海科创新研究院有限公司 2023-12-05 CN disclosed
CN-117175005-A Lithium ion battery electrolyte containing tri (2-cyanoethyl) phosphate and lithium ion battery 山东海科创新研究院有限公司 2023-12-05 CN disclosed
WO-1999014358-A1 CHEMILUMINESCENCE COMPOSITIONS AND METHODS LUMIGEN, INC. (US) 1999-03-25 WO disclosed
US-5840963-A HALOGEN-SUBSTITUTED HYDROQUINONES HAVING ONE HYDROXY GROUP PROTECTED BY PHOSPHATE GROUP LUMIGEN, INC. (US) 1998-11-24 US disclosed
US-5773628-A CHEMILUMINESCENT ASSAY OF PHOSPHATASE TROPIX, INC. (US) 1998-06-30 US disclosed
US-5772926-A ANALYSIS OF HYDROLYTIC ENZYMES AND ENZYME INHIBITORS; LABELED BINDING PAIRS LUMIGEN, INC. (US) 1998-06-30 US disclosed
EP-0819119-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR GENERATING CHEMILUMINESCENCE WITH PHOSPHATASE ENZYMES LUMIGEN, INC. (US) 1998-01-21 EP disclosed
EP-0790991-A4 1997-09-03 EP disclosed
EP-0790991-A1 NOVEL 1,2-DIOXETANE COMPOUNDS WITH HALOALKOXY GROUPS, METHODS OF PREPARATION AND USE TROPIX, INC. (US) 1997-08-27 EP disclosed
WO-1997026245-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR GENERATING CHEMILUMINESCENCE WITH PHOSPHATASE ENZYMES LUMIGEN, INC. (US) 1997-07-24 WO disclosed
WO-1996015122-A1 NOVEL 1,2-DIOXETANE COMPOUNDS WITH HALOALKOXY GROUPS, METHODS OF PREPARATION AND USE TROPIX, INC. (US) 1996-05-23 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 (1 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-11866754-B2 Trinucleotide mRNA cap analogs RNGTT, RNMT, CPSF7 P2RY14 2992/4885P2RY2 4076/4885P2RY4 3822/4885

“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.