SCHEMBL19924796

SCHEMBL19924796

O=C(NC(CN1CCC(C(F)(F)F)CC1)C(=O)O)OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.62
ITGB3 P05106 6/20 0.48
ITGA2B P08514 6/20 0.48
OPRK1 P41145 2/20 0.47
CASP1 P29466 1/20 0.46
BCHE P06276 2/20 0.46
ACHE P22303 2/20 0.46
CACNA1F O60840 1/20 0.46
CACNA1D Q01668 1/20 0.46
CACNA1S Q13698 1/20 0.46
CACNA1C Q13936 1/20 0.46
ITGAV P06756 1/20 0.45
ACE P12821 1/20 0.45
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
CTSK P43235 1/20 0.44

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
SCHEMBL19924794 1.00 HRH1 (0.62) HRH1ITGB3ITGA2BOPRK1CASP1
SCHEMBL23856080 0.81 HRH1 (0.57) HRH1ITGB3ITGA2BOPRK1IDO1
SCHEMBL23856082 0.81 HRH1 (0.57) HRH1ITGB3ITGA2BOPRK1IDO1
SCHEMBL5967157 0.81 HRH1 (0.59) HRH1ITGB3ITGA2BOPRK1CTSK
SCHEMBL15689075 0.80 ITGB3 (0.63) HRH1ITGB3ITGA2BOPRK1CASP1
SCHEMBL7525533 0.77 HRH1 (1.00) HRH1ITGB3ITGA2BOPRK1CASP1
SCHEMBL7519514 0.77 HRH1 (1.00) HRH1ITGB3ITGA2BOPRK1CASP1
SCHEMBL26089886 0.75 ITGB3 (0.58) ITGB3ITGA2BCASP1BCHEACHE
SCHEMBL26089884 0.75 ITGB3 (0.58) ITGB3ITGA2BCASP1BCHEACHE
SCHEMBL954856 0.75 CTSL (0.54) ITGB3ITGA2BCASP1IDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066361-A1 5,6,7,7a-Tetrahydrocyclopenta[f]pyrido[1,2-h][1,7] naphthyridin-11(4bH)-one Compounds and Methods of use Use (as amended) GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2025-02-27 US disclosed
US-12221444-B2 5,6,7,7a-tetrahydrocyclopenta[f]pyrido[1,2-h][1,7]naphthyridin-11(4bH)-one compounds and methods of use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2025-02-11 US disclosed
CN-116942663-A Compounds for the treatment of HBV 葛兰素史克知识产权开发有限公司 2023-10-27 CN disclosed
CN-111433206-B Compounds of formula (I) 葛兰素史克知识产权开发有限公司 2023-07-07 CN disclosed
EP-4180431-A1 CHEMICAL COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2023-05-17 EP disclosed
EP-3692040-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2022-12-28 EP disclosed
US-20220144834-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-05-12 US disclosed
WO-2021191827-A1 TRIPEPTIDES DERIVATIVES FOR TREATING SARS-COV-2 INFECTIONS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-09-30 WO disclosed
US-20200255428-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-08-13 US disclosed
CN-111433206-A Compound (I) 葛兰素史克知识产权开发有限公司 2020-07-17 CN disclosed
WO-2018154466-A1 DIHYDROQUINOLIZINONES AS ANTIVIRALS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-08-30 WO disclosed
WO-2018042343-A2 COMPOUNDS THAT INHIBIT 3C AND 3CL PROTEASES AND METHODS OF USE THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-08 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-12221444-B2 5,6,7,7a-tetrahydrocyclopenta[f]pyrido[1,2-h][1,7]naphthyridin-11(4bH)-one compounds and methods of use HAVCR2, HBS1L, HBG1 HRH1 47/4885ITGB3 3911/4885ITGA2B 3326/4885
US-20250066361-A1 5,6,7,7a-Tetrahydrocyclopenta[f]pyrido[1,2-h][1,7] naphthyridin-11(4bH)-one Compounds and Methods of use Use (as amended) HAVCR2, HMBS, HBS1L HRH1 152/4885ITGB3 3512/4885ITGA2B 2946/4885
US-20220144834-A1 Chemical Compounds HAVCR2, HBS1L, HLA-B HRH1 397/4885ITGB3 2895/4885ITGA2B 2889/4885
US-20200255428-A1 CHEMICAL COMPOUNDS HAVCR2, HBS1L, HLA-B HRH1 397/4885ITGB3 2895/4885ITGA2B 2889/4885

“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.