SCHEMBL1969935

SCHEMBL1969935

Cc1nc(Cl)ccc1C(=O)NC1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.60
NPC1 O15118 6/20 0.60
KMT2A Q03164 2/20 0.54
GAA P10253 1/20 0.54
LMNA P02545 3/20 0.52
GLA P06280 1/20 0.52
MAPK1 P28482 1/20 0.52
ADORA2A P29274 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 3/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
NR3C1 P04150 1/20 0.49
HTT P42858 1/20 0.49
ATM Q13315 1/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL1970134 0.85 SLC6A12 (0.62) RAB9ANPC1KMT2AGAALMNA
SCHEMBL30398637 0.84 SLC6A12 (0.44) RAB9ANPC1KMT2AGAAMAPK1
SCHEMBL25151515 0.84 SLC6A12 (0.44) RAB9ANPC1KMT2AGAAMAPK1
SCHEMBL25151972 0.83 GAA (0.54) RAB9ANPC1KMT2AGAALMNA
SCHEMBL1967732 0.82 RAB9A (0.53) RAB9ANPC1KMT2AGAALMNA
SCHEMBL1969860 0.82 KMT2A (0.53) RAB9ANPC1KMT2AGAALMNA
SCHEMBL5431692 0.80 RAB9A (0.60) RAB9ANPC1KMT2AGAALMNA
SCHEMBL5423494 0.80 RAB9A (0.60) RAB9ANPC1KMT2AGAALMNA
SCHEMBL5419386 0.80 LMNA (0.52) RAB9ANPC1KMT2AGAALMNA
SCHEMBL1971284 0.79 HSD11B1 (0.57) RAB9ANPC1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673938-B2 Chemical compounds ASTRAZENECA AB (SE) 2014-03-18 US disclosed
US-8673938-B2 Chemical compounds ASTRAZENECA AB (SE) 2014-03-18 US disclosed
US-8673938-B2 Chemical compounds ASTRAZENECA AB (SE) 2014-03-18 US disclosed
CN-101787016-B Pyridine carboxamides as 11-beta-hsd1 inhibitors ASTRAZENECA AB 2013-08-28 CN disclosed
EP-2233480-B1 Chemical compounds ASTRAZENECA AB (SE) 2013-05-29 EP disclosed
EP-2233480-B1 Chemical compounds ASTRAZENECA AB (SE) 2013-05-29 EP disclosed
CN-102603711-A Pyridine carboxamides as 11-beta-hsd1 inhibitors ASTRAZENECA AB 2012-07-25 CN disclosed
CN-101573336-B Pyridine carboxamides as 11-beta-HSD 1 inhibitors ASTRAZENECA AB 2012-03-21 CN disclosed
EP-2086939-B8 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2011-06-22 EP disclosed
US-7964618-B2 2-[(3R)-1-[5-(cyclohexylcarbamoyl)-6-propylsulfanyl-pyridin-2-yl]-3-piperidyl]acetic acid, for example; compounds possess human 11- beta-hydroxysteroid dehydrogenase type1 enzyme (11 beta HSD1) inhibitory activity and accordingly have value in treatment of disease states including metabolic syndrome ASTRAZENECA AB (SE) 2011-06-21 US disclosed
US-20090306075-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2009-12-10 US disclosed
US-20090306075-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2009-12-10 US disclosed
US-20090306075-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2009-12-10 US disclosed
CN-101573336-A Pyridine carboxamides as 11-beta-HSD 1 inhibitors ASTRAZENECA AB (SE) 2009-11-04 CN disclosed
EP-2086939-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS AstraZeneca AB (SE) 2009-08-12 EP disclosed
US-20080269288-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-10-30 US disclosed
US-20080269288-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-10-30 US disclosed
US-20080269288-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-10-30 US disclosed
WO-2008053194-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2008-05-08 WO disclosed
WO-2008053194-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2008-05-08 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-20080269288-A1 CHEMICAL COMPOUNDS HSD11B1, CYP11B1, CYP4A11 RAB9A 1176/4885NPC1 603/4885KMT2A 3039/4885
US-20090306075-A1 CHEMICAL COMPOUNDS HSD11B1, CYP11B1, CYP4A11 RAB9A 1176/4885NPC1 603/4885KMT2A 3039/4885

“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.