SCHEMBL146009

SCHEMBL146009

CC(C)Oc1cc(N)c(C(=O)O)c(OC(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 1/20 0.47
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.43
IRAK4 Q9NWZ3 2/20 0.40
MCL1 Q07820 3/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
PARP10 Q53GL7 1/20 0.39
EP300 Q09472 2/20 0.36
GLA P06280 1/20 0.36
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
F2 P00734 1/20 0.33
PLG P00747 1/20 0.33
PLAU P00749 1/20 0.33

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
SCHEMBL145232 0.87 ULK1 (0.47) ULK1ALDH1A1KMT2AIRAK4MCL1
SCHEMBL19543393 0.75 ULK1 (0.44) ULK1ALDH1A1KMT2AIRAK4MCL1
SCHEMBL1012409 0.74 CYP3A4 (0.51) ALDH1A1KMT2A
SCHEMBL29196801 0.73 ALDH1A1 (0.52) ALDH1A1KMT2AMCL1RXRARXRB
Methylamine SCHEMBL28933538 0.73 ULK1 (0.71) ULK1ALDH1A1KMT2AGRIN1
SCHEMBL25513185 0.72 ALDH1A1 (0.71) ALDH1A1KMT2AIRAK4MCL1RXRA
Hydrochloric Acid SCHEMBL4299984 0.72 CYP3A4 (0.50) ALDH1A1KMT2AMCL1
SCHEMBL28579350 0.72 ALDH1A1 (0.49) ULK1ALDH1A1KMT2AMCL1
SCHEMBL28599903 0.72 ULK1 (0.75) ULK1ALDH1A1KMT2AGRIN1
SCHEMBL8962727 0.72 ULK1 (0.39) ULK1ALDH1A1KMT2AIRAK4PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107252429-B Novel anti-inflammatory agent 雷斯韦洛吉克斯公司 2023-06-16 CN disclosed
EP-3431086-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2020-06-17 EP disclosed
US-20200129512-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2020-04-30 US disclosed
EP-3431086-A1 NOVEL ANTI-INFLAMMATORY AGENTS Resverlogix Corp. (CA) 2019-01-23 EP disclosed
EP-2421533-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2018-10-17 EP disclosed
US-20170333419-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2017-11-23 US disclosed
US-20170326143-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2017-11-16 US disclosed
CN-107252429-A New antiinflammatory 雷斯韦洛吉克斯公司 2017-10-17 CN disclosed
US-9757368-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2017-09-12 US disclosed
WO-2013186612-A1 THE USE OF SUBSTITUTED 2-PHENYL-3H-QUINAZOLIN-4-ONES AND ANALOGS FOR INHIBITING BET (BROMODOMAIN AND EXTRA TERMINAL DOMAIN) PROTEINS RVX THERAPEUTICS INC. (CA) 2013-12-19 WO disclosed
US-20130281398-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION RVX THERAPEUTICS INC. (CA) 2013-10-24 US disclosed
US-20120059002-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2012-03-08 US disclosed
EP-2421533-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2012-02-29 EP disclosed
WO-2010123975-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2010-10-28 WO 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 (5 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-20120059002-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ULK1 1893/4885ALDH1A1 1042/4885KMT2A 3505/4885
US-20130281398-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION PHKB, BAZ2A, EP300 ULK1 495/4885ALDH1A1 3920/4885KMT2A 199/4885
US-20170326143-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ULK1 1893/4885ALDH1A1 1042/4885KMT2A 3505/4885
US-20170333419-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ULK1 1893/4885ALDH1A1 1042/4885KMT2A 3505/4885
US-20200129512-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ULK1 1893/4885ALDH1A1 1042/4885KMT2A 3505/4885

“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.