SCHEMBL6154623

SCHEMBL6154623

N#Cc1cc(F)c(N[C@H]2CC[C@H](NC(=O)O)CC2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.44
USP30 Q70CQ3 1/20 0.43
PDE4B Q07343 12/20 0.41
PDE4A P27815 10/20 0.41
PDE4C Q08493 10/20 0.41
PDE4D Q08499 8/20 0.41
IRAK4 Q9NWZ3 2/20 0.38
KCNH2 Q12809 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36

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
SCHEMBL6154624 1.00 ROCK2 (0.44) ROCK2USP30PDE4BPDE4APDE4C
SCHEMBL6154752 0.81 GPR119 (0.44) ROCK2USP30IRAK4
SCHEMBL6154745 0.81 GPR119 (0.44) ROCK2USP30IRAK4
SCHEMBL3624947 0.77 ACHE (0.46) ROCK2PDE4BPDE4APDE4CPDE4D
SCHEMBL3624945 0.77 ACHE (0.46) ROCK2PDE4BPDE4APDE4CPDE4D
SCHEMBL3630454 0.76 KDM4E (0.41) ROCK2PDE4BPDE4APDE4CPDE4D
SCHEMBL3630458 0.76 KDM4E (0.41) ROCK2PDE4BPDE4APDE4CPDE4D
SCHEMBL3628372 0.74 ROCK2 (0.53) ROCK2PDE4BPDE4APDE4CPDE4D
SCHEMBL3628370 0.74 ROCK2 (0.53) ROCK2PDE4BPDE4APDE4CPDE4D
SCHEMBL6154611 0.73 AAK1 (0.43) IRAK4

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 2/4885USP30 4100/4885PDE4B 1288/4885

“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.