SCHEMBL11187

SCHEMBL11187

C#CCCCC(=O)N1CCCN(C)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
HTT P42858 2/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
LMNA P02545 1/20 0.44
KMT2A Q03164 5/20 0.44
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 2/20 0.44
GNAI3 P08754 2/20 0.39
GNAO1 P09471 2/20 0.39
GNAI1 P63096 2/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL11923486 0.94 ATM (0.44) ATMHTTL3MBTL1LMNAKMT2A
SCHEMBL31575913 0.85 ATM (0.65) ATMHTTL3MBTL1KMT2ATDP1
SCHEMBL10792 0.83 ATM (0.63) ATMHTTL3MBTL1KMT2ATDP1
SCHEMBL22623181 0.83 ATM (0.57) ATML3MBTL1LMNAKMT2ATDP1
SCHEMBL312470 0.83 KMT2A (0.44) ATMHTTLMNAKMT2ATDP1
SCHEMBL11908890 0.80 ATM (0.44) ATML3MBTL1LMNAKMT2ATDP1
SCHEMBL9617499 0.78 L3MBTL1 (0.71) ATML3MBTL1KMT2ATDP1MEN1
SCHEMBL3331128 0.78 L3MBTL1 (0.71) ATML3MBTL1KMT2ATDP1MEN1
SCHEMBL15648774 0.76 HRH3 (0.45) ATML3MBTL1LMNAKMT2ATDP1
SCHEMBL15759104 0.75 ATM (0.47) ATML3MBTL1KMT2ATDP1MEN1

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-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-9321773-B2 Compounds Respivert, Ltd. (GB) 2016-04-26 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
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
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 ATM 4099/4885HTT 1839/4885L3MBTL1 4133/4885
US-20140249164-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 ATM 4099/4885HTT 1839/4885L3MBTL1 4133/4885
US-20120208799-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 ATM 4099/4885HTT 1839/4885L3MBTL1 4133/4885
US-20180118754-A1 COMPOUNDS LTC4S, CYP11B2, LTB4R2 ATM 4099/4885HTT 1839/4885L3MBTL1 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.