SCHEMBL2551805

SCHEMBL2551805

Nc1ccc(Oc2ccnc(NC(=O)NCCN3CCOCC3)c2)c(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
CNR1 P21554 1/20 0.47
LMNA P02545 2/20 0.46
KMT2A Q03164 1/20 0.46
MAPK1 P28482 1/20 0.46
RAF1 P04049 2/20 0.45
MAPK14 Q16539 6/20 0.44
SRC P12931 5/20 0.44
SYK P43405 5/20 0.44
GSK3A P49840 6/20 0.43
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42
LCK P06239 1/20 0.41

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
SCHEMBL4333183 0.82 CA12 (0.48) SMN1; SMN2LMNAKMT2AMAPK1RAF1
SCHEMBL4333046 0.81 MAPK1 (0.47) SMN1; SMN2CNR1LMNAKMT2AMAPK1
SCHEMBL19731959 0.77 GSK3A (0.58) MAPK14SRCSYKGSK3A
SCHEMBL19731960 0.77 GSK3A (0.49) MAPK14SRCSYKGSK3A
SCHEMBL2550993 0.77 GCK (0.61) SRCSYKGSK3A
SCHEMBL19388675 0.76 SYK (0.55) MAPK14SRCSYKGSK3A
SCHEMBL14656609 0.76 MAPK14 (0.64) MAPK1RAF1MAPK14SRCSYK
SCHEMBL2548367 0.75 GCK (0.44) MAPK14
SCHEMBL14656568 0.75 AXL (0.43)
SCHEMBL19388734 0.75 GSK3A (0.48) MAPK14SRCSYKGSK3A

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
US-10000471-B2 Pyrazole P38 map kinase inhibitors RESPIVERT LIMITED (GB) 2018-06-19 US disclosed
US-10000471-B2 Pyrazole P38 map kinase inhibitors RESPIVERT LIMITED (GB) 2018-06-19 US disclosed
US-20170362208-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2017-12-21 US disclosed
US-20170362208-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2017-12-21 US disclosed
US-9771354-B2 Pyrazole p38 map kinase inhibitors RESPIVERT LTD. (GB) 2017-09-26 US disclosed
US-9771354-B2 Pyrazole p38 map kinase inhibitors RESPIVERT LTD. (GB) 2017-09-26 US disclosed
US-20160130256-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2016-05-12 US disclosed
US-20160130256-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2016-05-12 US disclosed
EP-2556065-B1 PYRAZOLE P38 MAP KINASE INHIBITORS RESPIVERT LTD (GB) 2014-12-17 EP disclosed
EP-2556065-A1 PYRAZOLE P38 MAP KINASE INHIBITORS Respivert Limited (GB) 2013-02-13 EP disclosed
US-20130029990-A1 PYRAZOLE P38 MAP KINASE INHIBITORS RESPIVERT LTD. (GB) 2013-01-31 US disclosed
US-20130029990-A1 PYRAZOLE P38 MAP KINASE INHIBITORS RESPIVERT LTD. (GB) 2013-01-31 US disclosed
WO-2011121366-A1 PYRAZOLE P38 MAP KINASE INHIBITORS RESPIVERT LIMITED (GB) 2011-10-06 WO disclosed
WO-2011121366-A1 PYRAZOLE P38 MAP KINASE INHIBITORS RESPIVERT LIMITED (GB) 2011-10-06 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-20170362208-A1 NOVEL COMPOUNDS ARG1, IL1B, LTB4R SMN1; SMN2 3419/4885CNR1 122/4885LMNA 1997/4885
US-10000471-B2 Pyrazole P38 map kinase inhibitors MAPK1, MAP3K1, MAPK3 SMN1; SMN2 4182/4885CNR1 1504/4885LMNA 2580/4885
US-20160130256-A1 NOVEL COMPOUNDS ARG1, IL1B, LTB4R SMN1; SMN2 3419/4885CNR1 122/4885LMNA 1997/4885
US-20130029990-A1 PYRAZOLE P38 MAP KINASE INHIBITORS MAPK1, MAP3K1, MAPK3 SMN1; SMN2 4102/4885CNR1 1547/4885LMNA 2631/4885

“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.