SCHEMBL2120699

SCHEMBL2120699

C=CC(=O)OCOCCOC

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.57
ALDH1A1 P00352 4/20 0.57
TP53 P04637 3/20 0.57
HIF1A Q16665 3/20 0.57
HSD17B10 Q99714 1/20 0.57
THRB P10828 2/20 0.47
HPGD P15428 1/20 0.47
CYP3A4 P08684 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL14028639 0.98 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL138941 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL20276156 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3008879 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1524206 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL864613 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL20276142 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL9190024 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1523809 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1317368 0.86 TSHR (0.79) TSHRALDH1A1TP53HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239922-A1 PHOTOCURABLE COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2024-07-18 US disclosed
US-20210024674-A1 POLYMER COMPOUND, COMPOSITION, INSULATING LAYER, AND ORGANIC THIN FILM TRANSISTOR SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-01-28 US disclosed
CN-106039313-A Chemosensory receptor ligand-based therapies 埃尔舍利克斯治疗公司 2016-10-26 CN disclosed
US-8318824-B2 Hydrophilic polyolefin sintered body ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-11-27 US disclosed
US-20120095121-A1 HYDROPHILIC POLYOLEFIN SINTERED BODY ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-04-19 US disclosed
EP-2174975-A1 HYDROPHILIC POLYOLEFIN SINTERED BODY Asahi Kasei Chemicals Corporation (JP) 2010-04-14 EP disclosed
US-7012064-B2 Systemically administering cyclic peptide compound, salt, ester or prodrug for reducing toxicity associated with the administration of cyclosporin A ENANTA PHARMACEUTICALS, INC. (US) 2006-03-14 US disclosed
US-6784156-B2 ESPECIALLY FOR TREATING ASTHMA ENANTA PHARMACEUTICALS, INC. 2004-08-31 US disclosed
EP-1365791-A2 CYCLOSPORINS FOR THE TREATMENT OF RESPIRATORY DISEASES Enanta Pharmaceuticals, Inc. (US) 2003-12-03 EP disclosed
US-20030186855-A1 Systemically administering cyclic peptide compound, salt, ester or prodrug for reducing toxicity associated with the administration of cyclosporin A ENANTA PHARMACEUTICALS, INC. 2003-10-02 US disclosed
US-20030109426-A1 Semisynthetic cyclosporin analogs of formula (I): treatment of asthma and other diseases characterized by airflow obstruction, their use as drugs as respiratory system disorders ENANTA PHARMACEUTICALS, INC. 2003-06-12 US disclosed
US-20020142946-A1 Cyclosporins for the treatment of respiratory diseases ENANTA PHARMACEUTICALS, INC. 2002-10-03 US disclosed
WO-2002069902-A2 CYCLOSPORINS FOR THE TREATMENT OF RESPIRATORY DISEASES ENANTA PHARMACEUTICALS, INC. (US) 2002-09-12 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-20030186855-A1 Systemically administering cyclic peptide compound, salt, ester or prodrug for reducing toxicity associated with the administration of cyclosporin A CCR1, CCR6, CHP1 TSHR 1449/4885ALDH1A1 3250/4885TP53 2539/4885
US-20030109426-A1 Semisynthetic cyclosporin analogs of formula (I): treatment of asthma and other diseases characterized by airflow obstruction, their use as drugs as respiratory system disorders CYP2S1, CYP2U1, CYC1 TSHR 1762/4885ALDH1A1 2327/4885TP53 4341/4885
US-20020142946-A1 Cyclosporins for the treatment of respiratory diseases CYC1, CYP2S1, CHP1 TSHR 2392/4885ALDH1A1 2962/4885TP53 3403/4885

“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.