SCHEMBL2610404

SCHEMBL2610404

CCCc1nc(C)ncc1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
STAT3 P40763 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
AOC3 Q16853 1/20 0.42
GAA P10253 1/20 0.41
BRD4 O60885 2/20 0.41
LMNA P02545 1/20 0.41
HTR1A P08908 2/20 0.41
DRD2 P14416 1/20 0.41
LIPE Q05469 1/20 0.40
TSHR P16473 1/20 0.39
ATP4A P20648 1/20 0.39
ATP4B P51164 1/20 0.39
LTA4H P09960 1/20 0.39
MAPK14 Q16539 1/20 0.39
ADRA1D P25100 1/20 0.38

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
SCHEMBL2117197 0.86 L3MBTL1 (0.44) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL2116656 0.84 L3MBTL1 (0.47) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL4120541 0.81 TSHR (0.49) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL2116065 0.80 HTT (0.58) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL30839874 0.78 L3MBTL1 (0.51) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL6639288 0.78 L3MBTL1 (0.51) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL21040513 0.77 L3MBTL1 (0.50) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL23472556 0.75 SMN1; SMN2 (0.49) MAPTMAPK1TDP1SMN1; SMN2LMNA
SCHEMBL3942081 0.74 TSHR (0.43) L3MBTL1MAPTMAPK1TDP1STAT3
SCHEMBL8192704 0.74 LTA4H (0.57) L3MBTL1MAPTMAPK1TDP1GAA

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-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 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 (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-20120095031-A1 CYCLOPROPANE COMPOUND HCRTR1, HCRTR2, CNR1 L3MBTL1 1292/4885MAPT 2476/4885MAPK1 1433/4885

“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.