SCHEMBL4283657

SCHEMBL4283657

NCc1cccc(OCCN2CCCC2)c1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
ALDH1A1 P00352 1/20 0.74
LTA4H P09960 10/20 0.62
BACE1 P56817 1/20 0.61
PRMT6 Q96LA8 1/20 0.55
HTT P42858 2/20 0.55
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.55
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54

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
SCHEMBL4286569 0.98 KDM4E (0.72) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL30831555 0.88 KDM4E (0.70) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL26985810 0.88 KDM4E (0.70) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL109617 0.87 LTA4H (0.59) KDM4ESMN1; SMN2ALDH1A1LTA4HHTT
SCHEMBL305458 0.85 KDM4E (1.00) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL6947417 0.84 PSMB1 (0.73) LTA4H
SCHEMBL13766268 0.84 KDM4E (0.97) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL6932153 0.84 KDM4E (0.72) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL14970709 0.84 KDM4E (0.97) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1
SCHEMBL30831642 0.83 KDM4E (0.71) KDM4ESMN1; SMN2ALDH1A1LTA4HBACE1

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-20090258907-A1 COMPOUNDS USEFUL AS INHIBITORS OF ROCK KINASES ABBOTT LABORATORIES (US) 2009-10-15 US disclosed
WO-2009126635-A1 2-AMINO-BENZOTHIAZOLE DERIVATES USEFUL AS INHIBITORS OF ROCK KINASES ABBOTT LABORATORIES (US) 2009-10-15 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-20090258907-A1 COMPOUNDS USEFUL AS INHIBITORS OF ROCK KINASES ROCK1, ROCK2, RHOA KDM4E 1119/4885SMN1; SMN2 2487/4885ALDH1A1 3461/4885

“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.