SCHEMBL277393

SCHEMBL277393

CCCCCC(CC)C(N)=O

nearest known ligand 0.87

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.87
CA1 P00915 5/20 0.87
MAPK1 P28482 1/20 0.56
GRIK1 P39086 2/20 0.50
GRIK2 Q13002 2/20 0.50
SLC1A2 P43004 2/20 0.50
SLC1A1 P43005 2/20 0.50
GPR84 Q9NQS5 3/20 0.43
FFAR1 O14842 1/20 0.43
SLC1A3 P43003 1/20 0.42
EPHX1 P07099 1/20 0.42
MAPT P10636 1/20 0.42
TP53 P04637 1/20 0.42
LAP3 P28838 1/20 0.42

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
SCHEMBL28156543 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL5090059 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL1665997 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL10706703 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL1668977 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
Hydrochloric Acid SCHEMBL8533142 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL3628614 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL3859929 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
SCHEMBL6119566 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2
Hydrochloric Acid SCHEMBL27624866 0.98 CA2 (0.83) CA2CA1MAPK1GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117794896-A Protease inhibitors for the treatment of coronavirus infections 斯克里普斯研究学院 2024-03-29 CN claimed
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 EP claimed
CN-116648451-A Antagonist compounds 阿道尔克斯治疗有限公司 2023-08-25 CN claimed
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 CN claimed
CN-116438166-A N-substituted 4- (1, 3-aryloxazol-2-yl) phenyl compounds for the treatment and prevention of hepatitis b virus infection 豪夫迈·罗氏有限公司 2023-07-14 CN claimed
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-03-02 US claimed
CN-115279747-A Novel fYN and VEGFR2 kinase inhibitors 罗达制药生物技术有限责任公司 2022-11-01 CN claimed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 WO claimed
CN-113613722-A Novel imidazole-pyrazole derivatives 豪夫迈·罗氏有限公司 2021-11-05 CN claimed
WO-2021060453-A1 CROSSLINKED OPTICALLY ACTIVE SECONDARY AMINE DERIVATIVE 大日本住友製薬株式会社 2021-04-01 WO claimed
WO-2004029050-A1 INDAZOLES, BENZOTHIAZOLES, AND BENZOISOTHIAZOLES, AND PREPARATION AND USES THEREOF MEMORY PHARMACEUTICALS CORPORATION (US) 2004-04-08 WO claimed
WO-1999007413-A1 SUBSTANCE P INHIBITORS IN COMBINATION WITH NMDA-BLOCKERS FOR TREATING PAIN ALGOS PHARMACEUTICAL CORPORATION (US) 1999-02-18 WO claimed
US-5869499-A Benzyloxyquinuclidines as substance P antagonists PFIZER INC (US) 1999-02-09 US claimed
US-5837711-A Substituted quinuclidines as substance P antagonists PFIZER INC. (US) 1998-11-17 US claimed
WO-1998027815-A1 SUBSTITUTED AMINOQUINOLINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY MERCK & CO., INC. (US) 1998-07-02 WO claimed
US-5750535-A Pharmaceutical agents for the treatment of disorders caused by helicobacter pylori or other spiral urease-positive gram-negative bacteria PFIZER INC. (US) 1998-05-12 US claimed
CN-1154240-A NK-1 receptor antagonists for treatment of cancer PFIZER (US) 1997-07-16 CN claimed
CN-1132072-A NK-1 receptor antagonists for the treatment of nerve injury and stroke PFIZER (US) 1996-10-02 CN claimed
EP-0665843-A1 SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS PFIZER INC. (US) 1995-08-09 EP claimed
WO-1994010170-A1 SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS PFIZER INC. (US) 1994-05-11 WO claimed

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-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD CA2 3949/4885CA1 4855/4885MAPK1 1659/4885

“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.