SCHEMBL11545

SCHEMBL11545

C#CCCCC(=O)N1CCC(N2CCOCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
L3MBTL3 Q96JM7 2/20 0.44
ACHE P22303 1/20 0.44
CBX7 O95931 1/20 0.42
CDYL2 Q8N8U2 1/20 0.42
CDYL Q9Y232 1/20 0.42
CDY1; CDY1B Q9Y6F8 1/20 0.42
GLA P06280 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 2/20 0.38
HIF1A Q16665 1/20 0.38
EPHX2 P34913 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL8847 0.85 GLA (0.54) KDM4EALDH1A1L3MBTL1GLANPC1
SCHEMBL15759106 0.81 GNAI3 (0.50) KDM4EALDH1A1L3MBTL1L3MBTL3ACHE
SCHEMBL10937 0.81 GLA (0.53) KDM4EALDH1A1L3MBTL1GLANPC1
SCHEMBL11927923 0.80 GNAI3 (0.56) KDM4EALDH1A1L3MBTL1L3MBTL3ACHE
SCHEMBL11923447 0.78 KDM4E (0.45) KDM4EALDH1A1L3MBTL1L3MBTL3ACHE
SCHEMBL13779 0.75 L3MBTL1 (0.50) ALDH1A1L3MBTL1GLANPC1LMNA
SCHEMBL13226743 0.75 NPC1 (0.50) ALDH1A1L3MBTL1NPC1MEN1KMT2A
SCHEMBL18909232 0.74 KDM4E (0.51) KDM4EALDH1A1L3MBTL1L3MBTL3ACHE
SCHEMBL19259632 0.74 KDM4E (0.51) KDM4EALDH1A1L3MBTL1L3MBTL3ACHE
SCHEMBL31575913 0.73 ATM (0.65) ALDH1A1L3MBTL1NPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180118754-A1 COMPOUNDS RESPIVERT LTD. (GB) 2018-05-03 US disclosed
US-20180118754-A1 COMPOUNDS RESPIVERT LTD. (GB) 2018-05-03 US disclosed
US-20180118754-A1 COMPOUNDS RESPIVERT LTD. (GB) 2018-05-03 US disclosed
US-9834560-B2 Compounds RESPIVERT LTD. (GB) 2017-12-05 US disclosed
US-9834560-B2 Compounds RESPIVERT LTD. (GB) 2017-12-05 US disclosed
US-9834560-B2 Compounds RESPIVERT LTD. (GB) 2017-12-05 US disclosed
US-20160264583-A1 COMPOUNDS RESPIVERT LTD. (GB) 2016-09-15 US disclosed
US-20160264583-A1 COMPOUNDS RESPIVERT LTD. (GB) 2016-09-15 US disclosed
US-20160264583-A1 COMPOUNDS RESPIVERT LTD. (GB) 2016-09-15 US disclosed
US-9321773-B2 Compounds Respivert, Ltd. (GB) 2016-04-26 US disclosed
US-20140249164-A1 COMPOUNDS RESPIVERT LTD (GB) 2014-09-04 US disclosed
US-20140249164-A1 COMPOUNDS RESPIVERT LTD (GB) 2014-09-04 US disclosed
US-8741909-B2 PI3 kinase inhibitors RESPIVERT LTD. (GB) 2014-06-03 US disclosed
US-8741909-B2 PI3 kinase inhibitors RESPIVERT LTD. (GB) 2014-06-03 US disclosed
US-8741909-B2 PI3 kinase inhibitors RESPIVERT LTD. (GB) 2014-06-03 US disclosed
EP-2491037-B1 QUINAZOLIN-4(3H)-ONE DERIVATIVES USED AS PI3 KINASE INHIBITORS RESPIVERT LTD (GB) 2014-04-30 EP disclosed
US-20120208799-A1 COMPOUNDS RESPIVERT LTD (GB) 2012-08-16 US disclosed
US-20120208799-A1 COMPOUNDS RESPIVERT LTD (GB) 2012-08-16 US disclosed
US-20120208799-A1 COMPOUNDS RESPIVERT LTD (GB) 2012-08-16 US disclosed
WO-2011048111-A1 COMPOUNDS RESPIVERT LIMITED (GB) 2011-04-28 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 (4 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-20160264583-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 KDM4E 3332/4885ALDH1A1 224/4885L3MBTL1 4133/4885
US-20140249164-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 KDM4E 3332/4885ALDH1A1 224/4885L3MBTL1 4133/4885
US-20120208799-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 KDM4E 3332/4885ALDH1A1 224/4885L3MBTL1 4133/4885
US-20180118754-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 KDM4E 3332/4885ALDH1A1 224/4885L3MBTL1 4133/4885

“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.