SCHEMBL19731960

SCHEMBL19731960

O=C(NCCN1CCOCC1)Nc1cc(Oc2ccc(NC(=O)Nc3cc(O)nn3-c3ccc(CO)cc3)c(Cl)c2Cl)ccn1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 16/20 0.49
MAPK14 Q16539 16/20 0.49
SRC P12931 14/20 0.49
SYK P43405 12/20 0.49
MAPK12 P53778 2/20 0.46
HCK P08631 1/20 0.42

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
SCHEMBL19731959 0.92 GSK3A (0.58) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL14656325 0.91 MAPK14 (0.59) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19732036 0.90 MAPK14 (0.52) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19388734 0.90 GSK3A (0.48) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19732042 0.86 GSK3A (0.45) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19732080 0.85 MAPK12 (0.47) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL14656609 0.84 MAPK14 (0.64) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19732041 0.84 MAPK14 (0.43) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19732003 0.84 MAPK12 (0.43) GSK3AMAPK14SRCSYKMAPK12
SCHEMBL19388675 0.83 SYK (0.55) GSK3AMAPK14SRCSYKMAPK12

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 2 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-20170362208-A1 NOVEL COMPOUNDS RESPIVERT LIMITED (GB) 2017-12-21 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 (2 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 GSK3A 3153/4885MAPK14 4207/4885SRC 3928/4885
US-10000471-B2 Pyrazole P38 map kinase inhibitors MAPK1, MAP3K1, MAPK3 GSK3A 990/4885MAPK14 31/4885SRC 872/4885

“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.