SCHEMBL535852

SCHEMBL535852

COCC(=O)Nc1cc(Oc2ccc(N)c3ccccc23)ccn1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.55
SRC P12931 9/20 0.55
GSK3A P49840 8/20 0.55
SYK P43405 7/20 0.55
MAPK12 P53778 4/20 0.55
HCK P08631 3/20 0.55
GSK3B P49841 1/20 0.55
RIOK2 Q9BVS4 2/20 0.47
MAPK10 P53779 1/20 0.47
GCK P35557 2/20 0.45
KDR P35968 1/20 0.44
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL14656468 0.89 MAPK14 (0.47) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL28705005 0.85 MAPK14 (0.51) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL13504234 0.85 KDR (0.47) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL13331029 0.84 GCK (0.49) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL12158272 0.84 HCK (0.55) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL2561277 0.84 SMN1; SMN2 (0.53) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL2554803 0.84 GCK (0.65) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL12281768 0.83 MAPK14 (0.43) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL28708295 0.83 GCK (0.45) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14656316 0.83 MAPK14 (0.44) MAPK14SRCGSK3ASYKMAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2556068-B1 P38 MAP KINASE INHIBITORS RESPIVERT LTD (GB) 2019-01-23 EP disclosed
EP-2556068-B1 P38 MAP KINASE INHIBITORS RESPIVERT LTD (GB) 2019-01-23 EP disclosed
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-9796742-B2 Kinase inhibitors RESPIVERT LIMITED (GB) 2017-10-24 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
EP-2890460-B1 KINASE INHIBITORS RESPIVERT LTD (GB) 2017-02-22 EP disclosed
US-20120136031-A1 P38MAP KINASE INHIBITOR RESPIVERT LTD. (GB) 2012-05-31 US disclosed
EP-2414347-A1 P38MAP KINASE INHIBITOR Respivert Limited (GB) 2012-02-08 EP disclosed
US-20110312963-A1 P38 MAP KINASE INHIBITORS RESPIVERT LTD (GB) 2011-12-22 US disclosed
US-20110312963-A1 P38 MAP KINASE INHIBITORS RESPIVERT LTD (GB) 2011-12-22 US disclosed
WO-2011124930-A1 P38 MAP KINASE INHIBITORS RESPIVERT LIMITED (GB) 2011-10-13 WO 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
WO-2010112936-A1 P38MAP KINASE INHIBITOR RESPIVERT LIMITED (GB) 2010-10-07 WO disclosed
WO-2010112936-A1 P38MAP KINASE INHIBITOR RESPIVERT LIMITED (GB) 2010-10-07 WO disclosed
WO-2010067130-A1 P38 MAP KINASE INHIBITORS RESPIVERT LIMITED (GB) 2010-06-17 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-20110312963-A1 P38 MAP KINASE INHIBITORS MAPKAPK2, MAPK1, MAPKAPK3 MAPK14 25/4885SRC 634/4885GSK3A 165/4885
US-20170362208-A1 NOVEL COMPOUNDS ARG1, IL1B, LTB4R MAPK14 4207/4885SRC 3928/4885GSK3A 3153/4885
US-10000471-B2 Pyrazole P38 map kinase inhibitors MAPK1, MAP3K1, MAPK3 MAPK14 31/4885SRC 872/4885GSK3A 990/4885
US-20120136031-A1 P38MAP KINASE INHIBITOR MAPK1, MAP3K1, MAP3K11 MAPK14 17/4885SRC 338/4885GSK3A 54/4885

“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.