SCHEMBL12239784

SCHEMBL12239784

CC[C@H](C)COC(C)=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL27869082 1.00 — —
SCHEMBL309720 1.00 — —
SCHEMBL19248370 0.89 ALDH1A1 (0.42) —
SCHEMBL15542043 0.89 ALDH1A1 (0.42) —
SCHEMBL12122472 0.89 ALDH1A1 (0.42) —
SCHEMBL25342022 0.89 ALDH1A1 (0.42) —
SCHEMBL29211194 0.88 MAPT (0.41) —
SCHEMBL9756912 0.87 TDP1 (0.48) —
SCHEMBL26133678 0.86 ALOX15 (0.46) —
SCHEMBL30173470 0.84 MAPT (0.42) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025217091-A1 ODORANTS FOR FLUIDS, ODORIZED FLUIDS, METHODS, AND SYSTEMS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2025-10-16 — — WO disclosed
WO-2025217099-A1 INHIBITORS FOR HYDROGEN EMBRITTLEMENT AND METHODS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2025-10-16 — — WO disclosed
WO-2025096734-A1 MICROCAPSULES FMC CORPORATION (US) 2025-05-08 — — WO disclosed
CN-117330692-B Method for analyzing liquorice polysaccharide based on UPLC-Q-TOF-MS/MS technology 康奇(天津)生物技术股份有限公司 2024-02-20 — — CN disclosed
CN-117330692-A Method for analyzing liquorice polysaccharide based on UPLC-Q-TOF-MS/MS technology 康奇(天津)生物技术股份有限公司 2024-01-02 — — CN disclosed
CN-116298043-A Screening method of inonotus obliquus active action quality markers and construction and application of chemical characterization map thereof 哈尔滨商业大学 2023-06-23 — — CN disclosed
EP-4128392-A1 LITHIUM-ION BATTERY WITH ANODE COMPRISING BLEND OF INTERCALATION-TYPE ANODE MATERIAL AND CONVERSION-TYPE ANODE MATERIAL Sila Nanotechnologies Inc. (US) 2023-02-08 — — EP disclosed
US-8664189-B2 RNA interference in skin indications RXI PHARMACEUTICALS CORPORATION (US) 2014-03-04 — — US disclosed
US-8039465-B2 Cytoskeletal active compounds, composition and use INSPIRE PHARMACEUTICALS, INC. (US) 2011-10-18 — — US disclosed
US-20110165084-A1 VIVO DETECTION OF PHOSPHOLIPASE ACTIVATION THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2011-07-07 — — US disclosed
US-20100130572-A1 CYTOSKELETAL ACTIVE COMPOUNDS, COMPOSITION AND USE LAMPE JOHN W 2010-05-27 — — US disclosed
US-7666861-B2 Cytoskeletal active compounds, composition and use INSPIRE PHARMACEUTICALS, INC. (US) 2010-02-23 — — US disclosed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 — — US disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 — — US disclosed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 — — US disclosed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 — — US disclosed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 — — US disclosed
US-20080119536-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-22 — — US disclosed
US-20080076735-A1 CYTOSKELETAL ACTIVE COMPOUNDS, COMPOSITION AND USE CHATTEM INC. 2008-03-27 — — US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 — — US disclosed
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