SCHEMBL1016262

SCHEMBL1016262

CC(=O)CC(=O)NC1C2CC3CC(C2)CC1C3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.65
HSD11B1 P28845 4/20 0.54
EPHX2 P34913 7/20 0.51
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 1/20 0.47

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
SCHEMBL13702321 0.82 L3MBTL1 (0.72) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL12968364 0.82 L3MBTL1 (0.72) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL1923226 0.82 L3MBTL1 (0.61) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL1402737 0.81 L3MBTL1 (0.66) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL15224285 0.80 L3MBTL1 (0.59) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL1402900 0.79 L3MBTL1 (0.59) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL618834 0.79 L3MBTL1 (0.59) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL19808153 0.79 L3MBTL1 (0.63) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1
SCHEMBL1223956 0.79 L3MBTL1 (0.57) L3MBTL1HSD11B1EPHX2HSD17B10EPHX1
SCHEMBL12344537 0.78 L3MBTL1 (1.00) L3MBTL1HSD11B1EPHX2HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10570157-B2 Cyclic diarylboron derivatives as NLRP3 inflammasome inhibitors THE UNIVERSITY OF MANCHESTER (GB) 2020-02-25 US disclosed
US-20180215772-A1 CYCLIC DIARYLBORON DERIVATIVES AS NLRP3 INFLAMMASOME INHIBITORS THE UNIVERSITY OF MANCHESTER (GB) 2018-08-02 US disclosed
US-8344016-B2 Pyrazole derivatives as 11-beta-HSD1 inhibitors ASTRAZENECA AB (SE) 2013-01-01 US disclosed
US-8344016-B2 Pyrazole derivatives as 11-beta-HSD1 inhibitors ASTRAZENECA AB (SE) 2013-01-01 US disclosed
US-8344016-B2 Pyrazole derivatives as 11-beta-HSD1 inhibitors ASTRAZENECA AB (SE) 2013-01-01 US disclosed
US-20110224273-A1 Pyrazole Derivatives as 11-Beta-HSD1 Inhibitors ASTRAZENECA AB (SE) 2011-09-15 US disclosed
US-20110224273-A1 Pyrazole Derivatives as 11-Beta-HSD1 Inhibitors ASTRAZENECA AB (SE) 2011-09-15 US disclosed
US-20110224273-A1 Pyrazole Derivatives as 11-Beta-HSD1 Inhibitors ASTRAZENECA AB (SE) 2011-09-15 US disclosed
EP-2292228-A1 Pyrazole derivatives as 11-beta-HSD1 inhibitors AstraZeneca AB (Publ) (SE) 2011-03-09 EP disclosed
EP-2292228-A1 Pyrazole derivatives as 11-beta-HSD1 inhibitors AstraZeneca AB (Publ) (SE) 2011-03-09 EP disclosed
EP-2271629-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 AstraZeneca AB (SE) 2011-01-12 EP disclosed
US-7816391-B2 4-[4-(2-adamantylcarbamoyl)-5-tert-butyl-pyrazol-1-yl]benzoic acid; hydroxysteroid reductase inhibitors; hydrolysis; metabolic syndromes ASTRAZENECA AB (SE) 2010-10-19 US disclosed
US-7816391-B2 4-[4-(2-adamantylcarbamoyl)-5-tert-butyl-pyrazol-1-yl]benzoic acid; hydroxysteroid reductase inhibitors; hydrolysis; metabolic syndromes ASTRAZENECA AB (SE) 2010-10-19 US disclosed
WO-2009130496-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-29 WO disclosed
US-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-22 US disclosed
US-20090221663-A1 PYRAZOLE DERIVATIVES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2009-09-03 US disclosed
US-20090221663-A1 PYRAZOLE DERIVATIVES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2009-09-03 US disclosed
WO-2008099145-A1 PYRAZOLE DERIVATIVES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2008-08-21 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-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 CYP2S1, HSD11B1, HSD3B1 L3MBTL1 4728/4885HSD11B1 2/4885EPHX2 756/4885
US-20110224273-A1 Pyrazole Derivatives as 11-Beta-HSD1 Inhibitors HSD11B1, HSD3B1, HSD11B2 L3MBTL1 4595/4885HSD11B1 1/4885EPHX2 1955/4885
US-10570157-B2 Cyclic diarylboron derivatives as NLRP3 inflammasome inhibitors NLRP3, IL1B, NOD1 L3MBTL1 2020/4885HSD11B1 270/4885EPHX2 2771/4885
US-20180215772-A1 CYCLIC DIARYLBORON DERIVATIVES AS NLRP3 INFLAMMASOME INHIBITORS NLRP3, IL1B, NOD1 L3MBTL1 2020/4885HSD11B1 270/4885EPHX2 2771/4885
US-20090221663-A1 PYRAZOLE DERIVATIVES AS 11-BETA-HSD1 INHIBITORS HSD11B1, HSD3B1, HSD11B2 L3MBTL1 4595/4885HSD11B1 1/4885EPHX2 1955/4885

“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.