SCHEMBL6154467

SCHEMBL6154467

COc1cc(Br)c(C)cc1C#N

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 13/20 0.51
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
IMPDH2 P12268 1/20 0.43
IMPDH1 P20839 1/20 0.43
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EGFR P00533 2/20 0.42
ERBB2 P04626 2/20 0.42
PGR P06401 1/20 0.41

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
SCHEMBL1981958 0.82 KDM4E (0.55) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL31503655 0.81 ALDH1A1 (0.53) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL2761994 0.80 ALDH1A1 (0.59) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL7980232 0.79 KDM4E (0.46) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL1039728 0.79 AR (0.54) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL4849000 0.78 AR (0.47) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL5468223 0.78 AR (0.47) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL31554560 0.78 ALDH1A1 (0.55) ARKDM4EUSP2ALDH1A1IMPDH2
SCHEMBL1505362 0.78 MAPT (0.52) MAPTNPSR1
SCHEMBL14720180 0.77 ALDH1A1 (0.44) ARKDM4EUSP2ALDH1A1IMPDH2

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 AR 1667/4885KDM4E 2017/4885USP2 3810/4885

“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.