SCHEMBL1402844

SCHEMBL1402844

O=C(CC(=O)C1CCCC1)NC1C2CC3CC(C2)CC1C3

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.64
L3MBTL1 Q9Y468 2/20 0.53
HSD17B10 Q99714 1/20 0.53
EPHX2 P34913 6/20 0.51
NPC1 O15118 1/20 0.51
EPHX1 P07099 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL1402948 0.97 HSD11B1 (0.59) HSD11B1L3MBTL1HSD17B10EPHX2NPC1
SCHEMBL19798424 0.76 KMT2A (0.58) HSD11B1L3MBTL1HSD17B10EPHX2NPC1
SCHEMBL15224285 0.74 L3MBTL1 (0.59) HSD11B1L3MBTL1HSD17B10EPHX2ALDH1A1
SCHEMBL1016262 0.74 L3MBTL1 (0.65) HSD11B1L3MBTL1HSD17B10EPHX2EPHX1
SCHEMBL19808153 0.74 L3MBTL1 (0.63) HSD11B1L3MBTL1HSD17B10EPHX2ALDH1A1
SCHEMBL2047350 0.72 HSD11B1 (0.53) HSD11B1L3MBTL1HSD17B10EPHX2NPC1
SCHEMBL12968364 0.72 L3MBTL1 (0.72) HSD11B1L3MBTL1HSD17B10EPHX2ALDH1A1
SCHEMBL4005434 0.72 L3MBTL1 (0.61) HSD11B1L3MBTL1HSD17B10EPHX2ALDH1A1
SCHEMBL11364035 0.72 EPHX1 (0.57) EPHX2NPC1EPHX1KMT2AALDH1A1
SCHEMBL4229104 0.72 L3MBTL1 (0.61) HSD11B1L3MBTL1HSD17B10EPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-101668524-B Pyrazole derivatives as 11-beta-HSD 1 inhibitors ASTRAZENECA AB 2012-10-24 CN disclosed
CN-102503891-A Pyrazole derivatives as 11-beta-hsd1 inhibitors ASTRAZENECA AB 2012-06-20 CN 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
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
CN-101668524-A Pyrazole derivatives as 11-beta-HSD 1 inhibitors ASTRAZENECA AB 2010-03-10 CN disclosed
EP-2124937-A1 PYRAZOLE DERIVATIVES AS 11-BETA-HSD1 INHIBITORS AstraZeneca AB (SE) 2009-12-02 EP 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
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 (2 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-20110224273-A1 Pyrazole Derivatives as 11-Beta-HSD1 Inhibitors HSD11B1, HSD3B1, HSD11B2 HSD11B1 1/4885L3MBTL1 4595/4885HSD17B10 30/4885
US-20090221663-A1 PYRAZOLE DERIVATIVES AS 11-BETA-HSD1 INHIBITORS HSD11B1, HSD3B1, HSD11B2 HSD11B1 1/4885L3MBTL1 4595/4885HSD17B10 30/4885

“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.