SCHEMBL16150798

SCHEMBL16150798

CCn1nc(C(C)(C)C)cc1NC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.47
CNR2 P34972 3/20 0.47
JAK2 O60674 1/20 0.46
CDK8 P49336 1/20 0.46
MAPK14 Q16539 10/20 0.46
NPSR1 Q6W5P4 1/20 0.45
GRN P28799 2/20 0.44
SORT1 Q99523 2/20 0.44
HPGD P15428 1/20 0.44
MAPK13 O15264 4/20 0.44
MAPK12 P53778 4/20 0.44
MAPK11 Q15759 4/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL16739349 0.85 CNR1 (0.62) CNR1CNR2JAK2MAPK14
SCHEMBL28751503 0.81 AURKA (0.43) LMNA
SCHEMBL1012925 0.81 MAPK14 (0.48) JAK2MAPK14NPSR1GRNSORT1
SCHEMBL12074507 0.81 CDK8 (0.41) CNR1CNR2JAK2CDK8MAPK14
SCHEMBL4603361 0.80 MAPK14 (0.44) CNR1CNR2JAK2MAPK14NPSR1
SCHEMBL1699062 0.80 MAPK14 (0.61) CNR2MAPK14GRNSORT1MAPK13
SCHEMBL9988597 0.79 ALDH1A1 (0.47) JAK2NPSR1HPGDLMNAMAPT
SCHEMBL284059 0.77 MAPK14 (0.45) CNR1CNR2JAK2MAPK14NPSR1
SCHEMBL2311794 0.77 GRN (0.66) CNR1CNR2NPSR1GRNSORT1
SCHEMBL4963431 0.77 MAPK14 (0.43) CNR1CNR2JAK2CDK8MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771353-B2 Kinase inhibitors based upon N-alkyl pyrazoles TOPIVERT PHARMA LIMITED (GB) 2017-09-26 US disclosed
EP-2981534-B1 KINASE INHIBITORS BASED UPON N-ALKYL PYRAZOLES TOPIVERT PHARMA LTD (GB) 2017-07-19 EP disclosed
US-20160039797-A1 KINASE INHIBITORS BASED UPON N-ALKYL PYRAZOLES OXULAR ACQUISITIONS LIMITED (GB) 2016-02-11 US disclosed
EP-2981534-A1 KINASE INHIBITORS BASED UPON N-ALKYL PYRAZOLES Topivert Pharma Limited (GB) 2016-02-10 EP disclosed
WO-2014162121-A1 KINASE INHIBITORS BASED UPON N-ALKYL PYRAZOLES TOPIVERT PHARMA LIMITED (GB) 2014-10-09 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 (1 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-20160039797-A1 KINASE INHIBITORS BASED UPON N-ALKYL PYRAZOLES SYK, LCK, BTK CNR1 2923/4885CNR2 2779/4885JAK2 162/4885

“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.