SCHEMBL15720161

SCHEMBL15720161

COc1cc(OCCOCCOCCN(C)C)cc([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.56
CHRNA4 P43681 1/20 0.56
ALDH1A1 P00352 6/20 0.45
LMNA P02545 2/20 0.45
KDM4E B2RXH2 3/20 0.45
MAPT P10636 3/20 0.44
HPGD P15428 2/20 0.43
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
KCNH2 Q12809 2/20 0.39
S1PR4 O95977 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL16106495 0.86 ALDH1A1 (0.49) CHRNB2CHRNA4ALDH1A1LMNAMAPT
SCHEMBL16106244 0.86 ALDH1A1 (0.49) CHRNB2CHRNA4ALDH1A1LMNAMAPT
SCHEMBL16150299 0.86 ALDH1A1 (0.49) CHRNB2CHRNA4ALDH1A1LMNAMAPT
SCHEMBL15720675 0.83 ALDH1A1 (0.47) CHRNB2CHRNA4ALDH1A1LMNAMAPT
SCHEMBL19434603 0.80 ALDH1A1 (0.44) CHRNB2CHRNA4ALDH1A1LMNAMAPT
SCHEMBL16106578 0.80 MEN1 (0.45) ALDH1A1LMNAMAPTHPGDKMT2A
SCHEMBL15721081 0.79 ALDH1A1 (0.48) ALDH1A1LMNAKDM4EMAPTTDP1
SCHEMBL15077283 0.77 CHRNB2 (0.65) CHRNB2CHRNA4ALDH1A1LMNAKDM4E
SCHEMBL15720873 0.76 CHRNB2 (0.39) CHRNB2CHRNA4ALDH1A1LMNAMAPT
SCHEMBL2310046 0.76 CHRNB2 (0.63) CHRNB2CHRNA4ALDH1A1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2981535-B1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS TOPIVERT PHARMA LTD (GB) 2020-12-16 EP disclosed
US-10435361-B2 Kinase inhibitors TOPIVERT PHARMA LIMITED (GB) 2019-10-08 US disclosed
US-20180044288-A1 KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2018-02-15 US disclosed
US-9790174-B2 Kinase inhibitors RESPIVERT LIMITED (GB) 2017-10-17 US disclosed
US-9732063-B2 Kinase inhibitors RESPIVERT LIMITED (GB) 2017-08-15 US disclosed
US-20160376232-A1 KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2016-12-29 US disclosed
US-9481648-B2 Kinase inhibitors RESPIVERT LIMITED (GB) 2016-11-01 US disclosed
EP-2925742-B1 KINASE INHIBITORS RESPIVERT LTD (GB) 2016-10-26 EP disclosed
EP-2981535-A1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS Respivert Limited (GB) 2016-02-10 EP disclosed
US-20150329523-A1 KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2015-11-19 US disclosed
EP-2925742-A1 KINASE INHIBITORS Respivert Limited (GB) 2015-10-07 EP disclosed
US-20150166483-A1 KINASE INHIBITORS RESPIVERT LTD (GB) 2015-06-18 US disclosed
WO-2014162126-A1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS RESPIVERT LIMITED (GB) 2014-10-09 WO disclosed
WO-2014076484-A1 KINASE INHIBITORS RESPIVERT LIMITED (GB) 2014-05-22 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 (5 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-20180044288-A1 KINASE INHIBITORS SYK, LYN, BTK CHRNB2 2344/4885CHRNA4 3412/4885ALDH1A1 4408/4885
US-20160376232-A1 KINASE INHIBITORS LYN, SYK, LCK CHRNB2 2788/4885CHRNA4 4513/4885ALDH1A1 3120/4885
US-20150166483-A1 KINASE INHIBITORS LCK, SYK, FYN CHRNB2 3341/4885CHRNA4 4463/4885ALDH1A1 4277/4885
US-20150329523-A1 KINASE INHIBITORS SYK, SRC, BTK CHRNB2 2178/4885CHRNA4 3163/4885ALDH1A1 4202/4885
US-10435361-B2 Kinase inhibitors SYK, LYN, BTK CHRNB2 2344/4885CHRNA4 3412/4885ALDH1A1 4408/4885

“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.