SCHEMBL6521740

SCHEMBL6521740

CC(C)(C)CC(=O)N1CCC(C(=O)O)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
POLB P06746 2/20 0.47
HSD17B10 Q99714 1/20 0.42
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
FAAH O00519 1/20 0.41
CREBBP Q92793 1/20 0.40
DPP4 P27487 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL20253124 0.85 FAAH (0.41) LMNAL3MBTL1FAAHDPP4NPC1
SCHEMBL12335217 0.84 LMNA (0.50) LMNAL3MBTL1POLBHSD17B10ITGB3
SCHEMBL6521320 0.82 POLB (0.53) LMNAL3MBTL1POLBHSD17B10ITGB3
SCHEMBL19195080 0.81 L3MBTL1 (0.50) LMNAL3MBTL1POLBITGB3ITGA2B
SCHEMBL13002469 0.81 DPP4 (0.44) FAAHDPP4NPC1ALDH1A1
SCHEMBL12384373 0.81 FAAH (0.43) FAAHDPP4NPC1ALDH1A1
SCHEMBL10146693 0.81 ALDH1A1 (0.60) LMNAFAAHDPP4NPC1RAB9A
SCHEMBL12720521 0.81 POLB (0.38) LMNAPOLBFAAH
SCHEMBL12308823 0.80 LMNA (0.46) LMNAL3MBTL1POLBHSD17B10ITGB3
SCHEMBL13965734 0.80 HRH3 (0.55) HSD17B10FAAHSMN1; SMN2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475644-B1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES HOFFMANN LA ROCHE (CH) 2014-01-08 EP claimed
US-8258158-B2 HSL inhibitors useful in the treatment of diabetes HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US claimed
EP-2475644-A1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. Hoffmann-La Roche AG (CH) 2012-07-18 EP claimed
WO-2011029808-A1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-17 WO claimed
US-20110065707-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES HOFFMANN-LA ROCHE, INC. 2011-03-17 US claimed
US-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2020-07-02 US disclosed
US-20190161471-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE CELTAXSYS INC (US) 2019-05-30 US disclosed
US-10202362-B2 Inhibitors of leukotriene A4 hydrolase CELTAXSYS, INC. (US) 2019-02-12 US disclosed
US-20180162836-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE CELLTAXIS, LLC 2018-06-14 US disclosed
EP-2475644-B1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES HOFFMANN LA ROCHE (CH) 2014-01-08 EP disclosed
US-20120295903-A1 FLAVIN DERIVATIVES BLOUNT KENNETH F (US) 2012-11-22 US disclosed
US-8258158-B2 HSL inhibitors useful in the treatment of diabetes HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
EP-2475644-A1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. Hoffmann-La Roche AG (CH) 2012-07-18 EP disclosed
WO-2011029808-A1 HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-17 WO disclosed
US-20110065707-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES HOFFMANN-LA ROCHE, INC. 2011-03-17 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 (6 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-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE RORA, RORC, RORB LMNA 4672/4885L3MBTL1 4845/4885POLB 4324/4885
US-20120295903-A1 FLAVIN DERIVATIVES BLVRB, FLAD1, FDPS LMNA 3529/4885L3MBTL1 1081/4885POLB 1461/4885
US-20190161471-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R LMNA 1225/4885L3MBTL1 1450/4885POLB 2412/4885
US-20180162836-A1 INHIBITORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R LMNA 1225/4885L3MBTL1 1450/4885POLB 2412/4885
US-20110065707-A1 NEW HSL INHIBITORS USEFUL IN THE TREATMENT OF DIABETES LIPE, PNLIP, LPL LMNA 779/4885L3MBTL1 503/4885POLB 4833/4885
US-10202362-B2 Inhibitors of leukotriene A4 hydrolase LTA4H, LTC4S, LTB4R LMNA 1225/4885L3MBTL1 1450/4885POLB 2412/4885

“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.