SCHEMBL6153437

SCHEMBL6153437

NC(=O)c1ccc(NC2CCCN(Cc3ccccc3)C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 6/20 0.60
ROCK1 Q13464 2/20 0.57
CCR2 P41597 2/20 0.57
JAK2 O60674 2/20 0.56
JAK3 P52333 2/20 0.56
GAA P10253 1/20 0.54
LTA4H P09960 2/20 0.52
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
KCNH2 Q12809 1/20 0.51
KAT2B Q92831 3/20 0.50
BCHE P06276 1/20 0.50
MAOB P27338 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL6156841 0.93 GAA (0.59) ROCK2ROCK1CCR2GAALTA4H
SCHEMBL6154433 0.91 LTA4H (0.61) ROCK2ROCK1CCR2GAALTA4H
SCHEMBL6153555 0.85 LTA4H (0.66) ROCK2ROCK1CCR2GAALTA4H
SCHEMBL5870954 0.85 ROCK2 (0.65) ROCK2ROCK1CCR2GAAKAT2B
SCHEMBL6399567 0.84 KDM4E (0.59) ROCK2ROCK1CCR2BCHE
Hydrochloric Acid SCHEMBL6157025 0.84 LTA4H (0.65) ROCK2ROCK1CCR2GAALTA4H
SCHEMBL6153938 0.84 KAT2B (0.53) ROCK2CCR2JAK2JAK3DRD2
SCHEMBL6154448 0.82 ROCK2 (0.61) ROCK2ROCK1CCR2GAALTA4H
SCHEMBL6153741 0.80 DRD4 (0.61) ROCK2ROCK1CCR2JAK2JAK3
SCHEMBL27936853 0.80 DRD2 (0.57) CCR2JAK2JAK3LTA4HDRD2

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 EP 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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 ROCK2 2/4885ROCK1 1/4885CCR2 1487/4885

“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.