SCHEMBL5577790

SCHEMBL5577790

CC(=O)N(Cc1ccccc1C1CCN(Cc2ccc(F)cc2)CC1)c1ccc(C)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.56
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.46
OPRM1 P35372 2/20 0.46
SIGMAR1 Q99720 3/20 0.45
MCHR1 Q99705 3/20 0.44
GAA P10253 2/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL5577665 0.93 ACHE (0.59) ACHEKDM4EMEN1KMT2ASIGMAR1
SCHEMBL5577523 0.92 ACHE (0.56) ACHEKDM4EMEN1KMT2ASIGMAR1
SCHEMBL5577631 0.90 ACHE (0.52) ACHEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5577751 0.90 ACHE (0.47) ACHEKDM4EMEN1ALDH1A1MAPK1
SCHEMBL5577309 0.90 ACHE (0.57) ACHEMEN1KMT2AOPRM1SIGMAR1
SCHEMBL5577819 0.88 ACHE (0.46) ACHEKDM4EMEN1ALDH1A1MAPK1
SCHEMBL5577339 0.87 KDM4E (0.50) ACHEKDM4EMEN1ALDH1A1MAPK1
SCHEMBL5577663 0.86 ACHE (0.49) ACHEKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5577466 0.86 ACHE (0.52) ACHEMEN1KMT2ASIGMAR1GAA
SCHEMBL5577437 0.85 ACHE (0.49) ACHEKDM4EMEN1KMT2ASIGMAR1

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-20070043079-A1 Heterocyclic compound containing nitrogen atom and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-02-22 US disclosed
EP-1616862-A1 NITROGENOUS HETEROCYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-01-18 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-20070043079-A1 Heterocyclic compound containing nitrogen atom and use thereof HLA-DRB1, MIF, HLA-C ACHE 1504/4885KDM4E 4213/4885MEN1 748/4885

“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.