SCHEMBL4027366

SCHEMBL4027366

N[C@@H](CCO)C(=O)OC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
EPHX1 P07099 2/20 0.37
CYP19A1 P11511 3/20 0.36
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
CYP2C19 P33261 1/20 0.35
TYR P14679 1/20 0.34
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
GRIN1 Q05586 1/20 0.31

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
SCHEMBL4027364 1.00 NAAA (0.39) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL4031737 1.00 NAAA (0.39) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL15543405 0.89 MAPK13 (0.39) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL18075110 0.85 EPHX1 (0.39) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL18075109 0.85 EPHX1 (0.39) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL3344777 0.84 NAAA (0.39) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL19723190 0.84 NAAA (0.45) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL28510618 0.84 NAAA (0.45) NAAAL3MBTL1EPHX1CYP19A1MAPK13
SCHEMBL16086118 0.83 EPHX1 (0.42) NAAAL3MBTL1EPHX1CYP19A1CYP2C19
SCHEMBL15359992 0.83 EPHX1 (0.42) NAAAL3MBTL1EPHX1CYP19A1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203711-A1 Inhibitors of P38 Map Kinase CHROMA THERAPEUTICS LTD. (GB) 2009-08-13 US disclosed
EP-2016055-A1 INHIBITORS OF P38 MAP KINASE Chroma Therapeutics Limited (GB) 2009-01-21 EP disclosed
WO-2007129036-A1 INHIBITORS OF P38 MAP KINASE CHROMA THERAPEUTICS LTD. (GB) 2007-11-15 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-20090203711-A1 Inhibitors of P38 Map Kinase MAPK1, MAPK3, CNKSR1 NAAA 2196/4885L3MBTL1 712/4885EPHX1 388/4885

“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.