SCHEMBL223631

SCHEMBL223631

CC12CC[C@](C(=O)O)(OC1=O)C2(C)C

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.59
GAA P10253 3/20 0.59
ALOX12 P18054 1/20 0.56
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
PTBP1 P26599 1/20 0.55
TSHR P16473 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
HTT P42858 2/20 0.54
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.49

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
SCHEMBL5575317 1.00 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL3192032 1.00 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL6206953 1.00 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL98457 1.00 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL17816948 0.85 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL15143001 0.85 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL4124556 0.85 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL6479731 0.85 POLB (0.59) POLBGAAALOX12KMT2AMEN1
SCHEMBL7158782 0.83 POLB (0.58) POLBGAAALOX12KMT2AMEN1
SCHEMBL6714428 0.83 POLB (0.58) POLBGAAALOX12KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999741-B2 Process for the synthesis of 6-((3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl)-3-(tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one CARDURION PHARMACEUTICALS, INC. (US) 2024-06-04 US claimed
US-20230122169-A1 NOVEL METHOD FOR PREPARING (-)-CIBENZOLINE SUCCINATE CELLTRION, INC. (KR) 2023-04-20 US claimed
EP-3858816-A1 NOVEL METHOD FOR PREPARING (-)-CIBENZOLINE SUCCINATE Celltrion, Inc. (KR) 2021-08-04 EP claimed
WO-2020067683-A1 NOVEL PROCESS FOR THE PREPARATION OF (+)-CIBENZOLINE SUCCINATE CELLTRION INC. (KR) 2020-04-02 WO claimed
US-20170233382-A1 PROCESSES FOR THE PREPARATION OF A BACE INHIBITOR MERCK SHARP & DOHME CORP. (US) 2017-08-17 US claimed
US-7161008-B2 Optically active β-aminoketones, optically active 1,3-amino alcohols and processes for preparing them Sanofi - Aventis Deutschland GmbH (DE) 2007-01-09 US claimed
US-20040030145-A1 Optically active B-aminoketones, optically active 1,3-amino alcohols and processes for preparing them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-02-12 US claimed
US-RE38334-E1 Diagnostics and therapeutics based on the roles of 3-PPI in intracellular signaling NUTRIMED BIOTECH 2003-11-25 US claimed
US-6020506-A Synthesis of D-3 phosphorylated phosphoinositides and analogues NUTRIMED BIOTECH (US) 2000-02-01 US claimed
EP-4234546-B1 IMPROVED SYNTHESIS OF KEY INTERMEDIATE OF KRAS G12C INHIBITOR COMPOUND AMGEN INC (US) 2026-04-15 EP disclosed
US-12533343-B2 Method for preparing (−)-cibenzoline succinate CELLTRION, INC. (KR) 2026-01-27 US disclosed
US-20260015355-A1 METHOD FOR THE PREPARATION OF (4S)-4-(4-CYANO-2-METHOXYPHENYL)-5-ETHOXY-2,8-DIMETHYL-1,4-DIHYDRO-1-6-NAPHTHYRIDINE-3-CARBOX-AMIDE BY RACEMATE SEPARATION BY MEANS OF DIASTEREOMERIC TARTARIC ACID ESTERS BAYER AKTIENGESELLSCHAFT (DE) 2026-01-15 US disclosed
US-20250368642-A1 SYNTHESIS OF KEY INTERMEDIATE OF KRAS G12C INHIBITOR COMPOUND AMGEN INC. (US) 2025-12-04 US disclosed
US-20250368643-A1 SYNTHESIS OF KEY INTERMEDIATE OF KRAS G12C INHIBITOR COMPOUND AMGEN INC. (US) 2025-12-04 US disclosed
US-5385921-A Treatment for neurodegeneration, alzheimer's disease, huntington's chorea; antihypoxic agents, antiischemic agents AKTIEBOLAGET ASTRA (SE) 1995-01-31 US disclosed
US-5380729-A Treatment or prevention of neurodegenerative disorders or neurotoxic injuries STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
US-5231103-A Lipoxygenase inhibitors as antiinflammatory agents, antiasthma and cardiovascular disorders BAYER AKTIENGESELLSCHAFT (DE) 1993-07-27 US disclosed
US-5091387-A Spirocyclic oxytocin antagonists MERCK & CO., INC. (US) 1992-02-25 US disclosed
EP-0450761-A1 Spirocyclic oxytocin antagonists MERCK & CO. INC. (US) 1991-10-09 EP disclosed
EP-0444945-A2 Use of spirocyclic compounds as oxytocin antagonists MERCK & CO. INC. (US) 1991-09-04 EP 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 (8 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-20170233382-A1 PROCESSES FOR THE PREPARATION OF A BACE INHIBITOR BACE2, BACE1, APP POLB 1044/4885GAA 12/4885ALOX12 2536/4885
US-11999741-B2 Process for the synthesis of 6-((3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl)-3-(tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one CDK8, PRMT8, RPS8 POLB 704/4885GAA 1985/4885ALOX12 3987/4885
US-20040030145-A1 Optically active B-aminoketones, optically active 1,3-amino alcohols and processes for preparing them ORMDL3, OR10J3, BCAT2 POLB 3235/4885GAA 3204/4885ALOX12 1073/4885
US-20260015355-A1 METHOD FOR THE PREPARATION OF (4S)-4-(4-CYANO-2-METHOXYPHENYL)-5-ETHOXY-2,8-DIMETHYL-1,4-DIHYDRO-1-6-NAPHTHYRIDINE-3-CARBOX-AMIDE BY RACEMATE SEPARATION BY MEANS OF DIASTEREOMERIC TARTARIC ACID ESTERS NR3C2, SRD5A1, SRD5A2 POLB 1384/4885GAA 3212/4885ALOX12 2693/4885
US-20250368643-A1 SYNTHESIS OF KEY INTERMEDIATE OF KRAS G12C INHIBITOR COMPOUND KRAS, NRAS, HRAS POLB 842/4885GAA 2623/4885ALOX12 4239/4885
US-20230122169-A1 NOVEL METHOD FOR PREPARING (-)-CIBENZOLINE SUCCINATE SDHA, SDHB, ALDH5A1 POLB 2046/4885GAA 1066/4885ALOX12 3784/4885
US-20250368642-A1 SYNTHESIS OF KEY INTERMEDIATE OF KRAS G12C INHIBITOR COMPOUND KRAS, NRAS, HRAS POLB 842/4885GAA 2623/4885ALOX12 4239/4885
US-12533343-B2 Method for preparing (−)-cibenzoline succinate CIP2A, CACNA1A, SDHA POLB 1578/4885GAA 1808/4885ALOX12 4367/4885

“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.