SCHEMBL5577438

SCHEMBL5577438

Cc1ccccc1CN(Cc1ccccc1C1CCN(Cc2ccc(F)cc2)CC1)S(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
SIGMAR1 Q99720 3/20 0.41
ACHE P22303 3/20 0.41
BCHE P06276 2/20 0.41
ATM Q13315 1/20 0.40
GAA P10253 2/20 0.40
LMNA P02545 1/20 0.40
BACE1 P56817 1/20 0.39
MLNR O43193 1/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL5577284 0.91 MCHR1 (0.43) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577994 0.91 MEN1 (0.48) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577830 0.90 MEN1 (0.49) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577707 0.89 MEN1 (0.45) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577351 0.88 MEN1 (0.54) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577267 0.88 DRD2 (0.42) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577766 0.87 APLNR (0.48) MEN1KMT2ASIGMAR1ACHEATM
SCHEMBL5577407 0.86 ALDH1A1 (0.52) KDM4ETDP1MEN1KMT2ASIGMAR1
SCHEMBL5577363 0.86 LMNA (0.52) KDM4EMEN1KMT2ASIGMAR1ACHE
SCHEMBL5577935 0.86 SIGMAR1 (0.48) KDM4EMEN1KMT2ASIGMAR1ACHE

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 KDM4E 4213/4885TDP1 3686/4885MEN1 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.