SCHEMBL14656609

SCHEMBL14656609

COc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc(NC(=O)NCCN4CCOCC4)c3)c(Cl)c2Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.64
SRC P12931 15/20 0.64
GSK3A P49840 14/20 0.64
SYK P43405 12/20 0.64
MAPK12 P53778 3/20 0.59
HCK P08631 2/20 0.59
MAPK13 O15264 2/20 0.53
TNF P01375 2/20 0.53
MAPK11 Q15759 2/20 0.53
CIT O14578 1/20 0.53
MUSK O15146 1/20 0.53
MAP3K7 O43318 1/20 0.53
RIPK2 O43353 1/20 0.53
STK10 O94804 1/20 0.53
MAP4K4 O95819 1/20 0.53
CHEK2 O96017 1/20 0.53
ABL1 P00519 1/20 0.53
EGFR P00533 1/20 0.53
RAF1 P04049 1/20 0.53
NTRK1 P04629 1/20 0.53

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
SCHEMBL14656325 0.93 MAPK14 (0.59) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL19731959 0.92 GSK3A (0.58) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14656293 0.91 MAPK14 (0.63) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14656207 0.89 MAPK14 (0.64) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14668272 0.89 MAPK14 (0.64) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL19388675 0.88 SYK (0.55) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14656345 0.88 MAPK14 (0.63) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14656364 0.88 MAPK14 (0.62) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL14656331 0.88 MAPK14 (0.65) MAPK14SRCGSK3ASYKMAPK12
SCHEMBL1292752 0.85 MAPK14 (0.78) 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 16 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 claimed
US-20170362208-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2017-12-21 US claimed
US-9771354-B2 Pyrazole p38 map kinase inhibitors RESPIVERT LTD. (GB) 2017-09-26 US claimed
US-20160130256-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2016-05-12 US claimed
US-20130029990-A1 PYRAZOLE P38 MAP KINASE INHIBITORS RESPIVERT LTD. (GB) 2013-01-31 US claimed
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
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

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 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-20160130256-A1 NOVEL COMPOUNDS ARG1, IL1B, LTB4R MAPK14 4207/4885SRC 3928/4885GSK3A 3153/4885
US-20130029990-A1 PYRAZOLE P38 MAP KINASE INHIBITORS MAPK1, MAP3K1, MAPK3 MAPK14 31/4885SRC 834/4885GSK3A 959/4885

“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.