SCHEMBL2076706

SCHEMBL2076706

CCCC(O)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.43
SLC1A3 P43003 2/20 0.42
SLC1A2 P43004 2/20 0.42
SLC1A1 P43005 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
PPARG P37231 2/20 0.42
PPARA Q07869 2/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.41
RCE1 Q9Y256 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL3338742 0.89 CETP (0.44) CA1SLC1A3SLC1A2SLC1A1MEN1
SCHEMBL29172647 0.88 CA1 (0.48) CA1SLC1A3SLC1A2SLC1A1MEN1
SCHEMBL2799652 0.87 CSNK1E (0.50) TSHRALDH1A1MAPK1CETP
SCHEMBL8086653 0.86 CSNK1E (0.53) MEN1KMT2AALDH1A1CETP
SCHEMBL31548009 0.86 CSNK1E (0.53) MEN1KMT2AALDH1A1CETP
SCHEMBL23857754 0.86 CSNK1E (0.53) MEN1KMT2AALDH1A1CETP
SCHEMBL9684327 0.86 CSNK1E (0.53) MEN1KMT2AALDH1A1CETP
SCHEMBL29121124 0.86 CSNK1E (0.53) MEN1KMT2AALDH1A1CETP
SCHEMBL27945819 0.86 CSNK1E (0.53) MEN1KMT2AALDH1A1CETP
SCHEMBL22369700 0.84 CA1 (0.45) CA1CYP2C19KMT2ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103146481-B Method for preparing tobacco maillard reaction spice HUABAO FOOD FLAVORS AND FRAGRANCES SHANGHAI CO LTD 2014-05-28 CN claimed
CN-103146481-A Method for preparing tobacco maillard reaction spice HUABAO FOOD FLAVORS AND FRAGRANCES SHANGHAI CO LTD 2013-06-12 CN claimed
CN-116368131-B Novel Smad3 protein degradation agent and application thereof 和径医药科技(上海)有限公司 2024-09-20 CN disclosed
CN-116368131-A Novel Smad3 protein degradation agent and application thereof 和径医药科技(上海)有限公司 2023-06-30 CN disclosed
CN-116253724-A Novel Smad3 protein degradation agent and application thereof 和径医药科技(上海)有限公司 2023-06-13 CN disclosed
US-11312964-B2 Compositions and methods for modulating growth hormone receptor expression IONIS PHARMACEUTICALS, INC. (US) 2022-04-26 US disclosed
US-20210207146-A1 COMPOSITIONS AND METHODS FOR MODULATING GROWTH HORMONE RECEPTOR EXPRESSION IONIS PHARMACEUTICALS, INC. (US) 2021-07-08 US disclosed
CN-107175119-B A kind of preparation method and applications of load-type vanadium phosphor oxide catalyst 中国石油化工股份有限公司 2019-11-15 CN disclosed
EP-1833824-B1 3-CYCLOALKYLCARBONYL INDOLES AS CANNABINOID RECEPTOR LIGANDS ABBVIE INC (US) 2016-08-03 EP disclosed
CN-103146481-B Method for preparing tobacco maillard reaction spice HUABAO FOOD FLAVORS AND FRAGRANCES SHANGHAI CO LTD 2014-05-28 CN disclosed
CN-103146481-A Method for preparing tobacco maillard reaction spice HUABAO FOOD FLAVORS AND FRAGRANCES SHANGHAI CO LTD 2013-06-12 CN disclosed
US-20110065685-A1 NOVEL INDOLES ARE CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-03-17 US disclosed
US-7750039-B2 Indoles are cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2010-07-06 US disclosed
US-7560481-B2 {1-[(1-methylpiperidin-2-yl)methyl]-1H-indol-3-yl}(2,2,3,3-tetramethylcyclopropyl)methanone toluenesufonic acid salt; selectively target cannaboid B2 receptors; analgesics for both nociceptive and neuropathic pain; side effect reduction; immunology modulators; antiinflammatory agents; neuroprotectants ABBOTT LABORATORIES (US) 2009-07-14 US disclosed
US-20090149501-A1 NOVEL INDOLES ARE CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-06-11 US disclosed
EP-1833824-A1 3-CYCLOALKYLCARBONYL INDOLES AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2007-09-19 EP disclosed
US-20070037801-A1 {1-[(1-methylpiperidin-2-yl)methyl]-1H-indol-3-yl}(2,2,3,3-tetramethylcyclopropyl)methanone toluenesufonic acid salt; selectively target cannaboid B2 receptors; analgesics for both nociceptive and neuropathic pain; side effect reduction; immunology modulators; antiinflammatory agents; neuroprotectants ABBVIE INC. 2007-02-15 US disclosed
WO-2006069196-A1 3-CYCLOALKYLCARBONYL INDOLES AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2006-06-29 WO disclosed
US-5242511-A COPPER ALLOY COMPOSITIONS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1993-09-07 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 (3 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-20090149501-A1 NOVEL INDOLES ARE CANNABINOID RECEPTOR LIGANDS CNR2, CNR1, OPRL1 CA1 2894/4885SLC1A3 1216/4885SLC1A2 624/4885
US-20070037801-A1 {1-[(1-methylpiperidin-2-yl)methyl]-1H-indol-3-yl}(2,2,3,3-tetramethylcyclopropyl)methanone toluenesufonic acid salt; selectively target cannaboid B2 receptors; analgesics for both nociceptive and neuropathic pain; side effect reduction; immunology modulators; antiinflammatory agents; neuroprotectants CNR2, CNR1, TRPV1 CA1 3423/4885SLC1A3 2215/4885SLC1A2 1032/4885
US-20110065685-A1 NOVEL INDOLES ARE CANNABINOID RECEPTOR LIGANDS CNR2, CNR1, OPRL1 CA1 2894/4885SLC1A3 1216/4885SLC1A2 624/4885

“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.