SCHEMBL12528611

SCHEMBL12528611

CC(C)N1CCN(C(C)(C)C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ PER2 O15055 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL19443027 0.88 PER2 (0.36) PIK3CDPOLBPER2
SCHEMBL23790356 0.82 PIK3CD (0.31) PIK3CDPER2
SCHEMBL18792809 0.81 PIK3CD (0.32) PIK3CDPOLBALDH1A1
SCHEMBL18643112 0.80 PIK3CD (0.30) PIK3CD
SCHEMBL24335867 0.80 PKM (0.30) PIK3CD
SCHEMBL596921 0.78 PER2 (0.38) PIK3CDPER2ALDH1A1
SCHEMBL611663 0.78 POLB (0.35) PIK3CDPOLB
SCHEMBL21690604 0.75 — —
SCHEMBL21325293 0.74 — —
SCHEMBL27423373 0.74 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037323-B2 Uracil derivatives as Mer-AXL inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 — — US disclosed
US-12037323-B2 Uracil derivatives as Mer-AXL inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 — — US disclosed
US-20240217952-A1 TREATMENT OF GRAFT-VERSUS-HOST DISEASE WITH INHIBITORS OF BET FAMILY BDII BROMODOMAIN POSEIDON INNOVATION 1, INC. 2024-07-04 — — US disclosed
US-20230339891-A1 URACIL DERIVATIVES AS MER-AXL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-10-26 — — US disclosed
US-20230339891-A1 URACIL DERIVATIVES AS MER-AXL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-10-26 — — US disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 — — US disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 — — US disclosed
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof OCUTERRA THERAPEUTICS, INC. (US) 2023-06-27 — — US disclosed
US-11685737-B2 Fluorinated integrin antagonists OCUTERRA THERAPEUTICS, INC. (US) 2023-06-27 — — US disclosed
US-20230129394-A1 METHODS OF TREATING OR PREVENTING VIRAL INFECTION WITH FLUORINATED AlphaV INTEGRIN ANTAGONISTS FELIQS CORPORATION (JP) 2023-04-27 — — US disclosed
US-20190225609-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FELIQS CORPORATION (JP) 2019-07-25 — — US disclosed
US-10301307-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof SCIFLUOR LIFE SCIENCES, INC. (US) 2019-05-28 — — US disclosed
US-20190040073-A1 NONANOIC AND DECANOIC ACID DERIVATIVES AND USES THEREOF SCIFLUOR LIFE SCIENCES, INC. 2019-02-07 — — US disclosed
US-20170313708-A1 NONANOIC AND DECANOIC ACID DERIVATIVES AND USES THEREOF FELIQS CORPORATION (JP) 2017-11-02 — — US disclosed
US-9790222-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof SCIFLUOR LIFE SCIENCES, INC. (US) 2017-10-17 — — US disclosed
US-20130295049-A1 LINKED DIBENZIMIDAZOLE ANTIVIRALS ENANTA PHARMACEUTICALS, INC (US) 2013-11-07 — — US disclosed
US-20130178469-A1 NOVEL ANTIVIRAL AGENTS SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (SIOC) (CN) 2013-07-11 — — US disclosed
US-7968579-B2 Antifungal triazole derivatives DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2011-06-28 — — US disclosed
US-7879839-B2 For treatment and prevention of cardiac arrhythmias; (+-)-2-Morpholin-4-yl-2-phenyl-1,1-dipyridin-3-yl-ethanol; (+-)-2-[(2-methoxyethyl)(methyl)amino]-2-phenyl-1,1-dipyridin-3-ylethanol MERCK SHARP & DOHME CORP. (US) 2011-02-01 — — US disclosed
US-20080090794-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME LLC 2008-04-17 — — US 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 (14 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-11685737-B2 Fluorinated integrin antagonists ITGB5, ITGB1, ITGA5 PIK3CD 1173/4885POLB 4045/4885PER2 4158/4885
US-20230129394-A1 METHODS OF TREATING OR PREVENTING VIRAL INFECTION WITH FLUORINATED AlphaV INTEGRIN ANTAGONISTS ITGAV, ITGB1, ITGA1 PIK3CD 3632/4885POLB 1997/4885PER2 3451/4885
US-12037323-B2 Uracil derivatives as Mer-AXL inhibitors MERTK, DAPK1, AXL PIK3CD 653/4885POLB 1904/4885PER2 3262/4885
US-20080090794-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 PIK3CD 1372/4885POLB 4819/4885PER2 1231/4885
US-11723980-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 PIK3CD 321/4885POLB 2088/4885PER2 4086/4885
US-10301307-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof FFAR3, FFAR2, FFAR1 PIK3CD 2051/4885POLB 4210/4885PER2 3422/4885
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof FFAR3, FFAR2, FFAR1 PIK3CD 2051/4885POLB 4210/4885PER2 3422/4885
US-20240217952-A1 TREATMENT OF GRAFT-VERSUS-HOST DISEASE WITH INHIBITORS OF BET FAMILY BDII BROMODOMAIN BRDT, BET1, BRD4 PIK3CD 3717/4885POLB 453/4885PER2 2554/4885
US-20190040073-A1 NONANOIC AND DECANOIC ACID DERIVATIVES AND USES THEREOF FFAR3, FFAR2, FFAR1 PIK3CD 1552/4885POLB 4074/4885PER2 4511/4885
US-20230339891-A1 URACIL DERIVATIVES AS MER-AXL INHIBITORS MERTK, DAPK1, AXL PIK3CD 653/4885POLB 1904/4885PER2 3262/4885
US-20190225609-A1 FLUORINATED TETRAHYDRONAPHTHYRIDINYL NONANOIC ACID DERIVATIVES AND USES THEREOF FFAR3, FFAR2, FFAR1 PIK3CD 2051/4885POLB 4210/4885PER2 3422/4885
US-20130178469-A1 NOVEL ANTIVIRAL AGENTS EIF2AK2, IFNAR1, IRF3 PIK3CD 1454/4885POLB 937/4885PER2 1752/4885
US-20130295049-A1 LINKED DIBENZIMIDAZOLE ANTIVIRALS EIF2AK2, ZC3HAV1, NSUN2 PIK3CD 451/4885POLB 332/4885PER2 1790/4885
US-20170313708-A1 NONANOIC AND DECANOIC ACID DERIVATIVES AND USES THEREOF FFAR3, FFAR2, FFAR1 PIK3CD 1552/4885POLB 4074/4885PER2 4511/4885

“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.

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