SCHEMBL5577407

SCHEMBL5577407

Cc1ccccc1N(Cc1ccccc1C1CCN(Cc2ccc(F)cc2)CC1)S(C)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
HTT P42858 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
SIGMAR1 Q99720 3/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
ATM Q13315 1/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
BACE1 P56817 1/20 0.38
DRD2 P14416 1/20 0.38

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
SCHEMBL5577837 0.90 MEN1 (0.45) ALDH1A1MEN1KMT2AKDM4ESIGMAR1
SCHEMBL5577289 0.90 MEN1 (0.53) MEN1KMT2ASIGMAR1BCHEACHE
SCHEMBL5577364 0.87 MEN1 (0.46) MEN1KMT2AKDM4ESIGMAR1BCHE
SCHEMBL5577590 0.86 MEN1 (0.41) ALDH1A1MEN1KMT2AKDM4ESIGMAR1
SCHEMBL5577438 0.86 KDM4E (0.44) MEN1KMT2AKDM4ETDP1SIGMAR1
SCHEMBL5577270 0.85 MEN1 (0.44) MEN1KMT2ASIGMAR1BCHEACHE
SCHEMBL5577258 0.84 RECQL (0.54) ALDH1A1MEN1KMT2ASIGMAR1BCHE
SCHEMBL5577663 0.83 ACHE (0.49) ALDH1A1MEN1KMT2AKDM4ESIGMAR1
SCHEMBL5577775 0.82 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ASIGMAR1BCHE
SCHEMBL5577311 0.82 MEN1 (0.46) MEN1KMT2AACHEATM

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 ALDH1A1 1147/4885HTT 2459/4885MEN1 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.