SCHEMBL2056773

SCHEMBL2056773

C=CNC(=O)OCCOCCOC(=O)NC=C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
ALDH1A1 P00352 4/20 0.52
TP53 P04637 2/20 0.52
HIF1A Q16665 2/20 0.52
HSD17B10 Q99714 1/20 0.52
THRB P10828 2/20 0.35
ACHE P22303 1/20 0.33
CYP3A4 P08684 1/20 0.32
SERPINE1 P05121 1/20 0.31
NPC1 O15118 1/20 0.30
RECQL P46063 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL11122001 0.93 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL21570869 0.84 TSHR (0.48) TSHRALDH1A1ACHECYP3A4NPC1
SCHEMBL12975855 0.83 TSHR (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL2056762 0.82 TSHR (0.52) TSHRALDH1A1ACHECYP3A4
SCHEMBL2116165 0.82
SCHEMBL3686781 0.80
SCHEMBL21787200 0.78 ACHE (0.41) TSHRALDH1A1ACHECYP3A4NPC1
SCHEMBL27803239 0.78 KDM4E (0.40) TSHRALDH1A1ACHESMN1; SMN2
SCHEMBL640238 0.78 THRB (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL5924841 0.77 HPGD (0.57) TSHRALDH1A1ACHENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112930487-B Ophthalmic device 鲍希与洛姆伯股份有限公司 2024-07-02 CN claimed
EP-3834017-A1 HIGH WATER CONTENT OPHTHALMIC DEVICES Bausch & Lomb Incorporated (US) 2021-06-16 EP claimed
US-10816698-B2 High water content ophthalmic devices BAUSCH & LOMB INCORPORATED (US) 2020-10-27 US claimed
US-10668676-B2 Ophthalmic devices BAUSCH & LOMB INCORPORATED (US) 2020-06-02 US claimed
US-20200049857-A1 HIGH WATER CONTENT OPHTHALMIC DEVICES SALIX PHARMACEUTICALS, LTD. 2020-02-13 US claimed
WO-2020032972-A1 HIGH WATER CONTENT OPHTHALMIC DEVICES BAUSCH & LOMB INCORPORATED (US) 2020-02-13 WO claimed
US-20200047437-A1 OPHTHALMIC DEVICES MEDICIS PHARMACEUTICAL CORPORATION 2020-02-13 US claimed
EP-3818401-B1 WATER EXTRACTABLE OPHTHALMIC DEVICES BAUSCH & LOMB (US) 2024-10-30 EP disclosed
CN-112352170-B Water extractable ophthalmic device 鲍希与洛姆伯股份有限公司 2024-08-23 CN disclosed
CN-112513681-B Water extraction ophthalmic device 鲍希与洛姆伯股份有限公司 2024-07-26 CN disclosed
EP-4396616-A1 OPHTHALMIC DEVICES Bausch + Lomb Ireland Limited (IE) 2024-07-10 EP disclosed
CN-112930487-B Ophthalmic device 鲍希与洛姆伯股份有限公司 2024-07-02 CN disclosed
US-11897985-B2 Water extractable ophthalmic devices BAUSCH & LOMB INCORPORATED (US) 2024-02-13 US disclosed
US-7901073-B2 Silicone hydrogel with composite hydrophilic and silicone polymers prepared with selective crosslink agents BAUSCH & LOMB INCORPORATED (US) 2011-03-08 US disclosed
WO-2010147864-A2 BIOMEDICAL DEVICES BAUSCH & LOMB INCORPORATED (US) 2010-12-23 WO disclosed
US-20100315588-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100315588-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
EP-2167555-A1 CROSSLINK AGENTS AND DUAL RADICAL CURE POLYMER Bausch & Lomb Incorporated (US) 2010-03-31 EP disclosed
US-20090018233-A1 Crosslink Agents and Dual Radical Cure Polymer SOLTA MEDICAL, INC. 2009-01-15 US disclosed
WO-2009009527-A1 CROSSLINK AGENTS AND DUAL RADICAL CURE POLYMER BAUSCH & LOMB INCORPORATED (US) 2009-01-15 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 (3 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-20090018233-A1 Crosslink Agents and Dual Radical Cure Polymer UACA, CRYAA, RAD51 TSHR 2555/4885ALDH1A1 1327/4885TP53 3048/4885
US-20200049857-A1 HIGH WATER CONTENT OPHTHALMIC DEVICES TCOF1, WDR1, UACA TSHR 1148/4885ALDH1A1 3002/4885TP53 2352/4885
US-10816698-B2 High water content ophthalmic devices TCOF1, WDR1, UACA TSHR 1148/4885ALDH1A1 3002/4885TP53 2352/4885

“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.