SCHEMBL5577649

SCHEMBL5577649

COC(=O)N(Cc1ccccc1C)Cc1ccccc1C1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
ATM Q13315 1/20 0.42
DRD3 P35462 1/20 0.42
CHRM4 P08173 1/20 0.42
MCHR1 Q99705 2/20 0.42
HRH3 Q9Y5N1 1/20 0.42
SLC6A12 P48065 1/20 0.41
TMEM97 Q5BJF2 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
SCHEMBL5577354 0.92 MCHR1 (0.51) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577606 0.91 GAA (0.54) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577298 0.91 MEN1 (0.53) SIGMAR1MEN1KMT2AKDM4EATM
SCHEMBL5577390 0.91 MEN1 (0.52) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577247 0.90 GAA (0.48) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577713 0.89 GAA (0.46) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577809 0.89 GAA (0.47) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577443 0.88 GAA (0.45) SIGMAR1MEN1KMT2AGAAKDM4E
SCHEMBL5577520 0.87 SIGMAR1 (0.45) SIGMAR1GAAKDM4ELMNACHRM4
SCHEMBL5577273 0.87 SIGMAR1 (0.45) SIGMAR1MEN1KMT2AGAAKDM4E

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 SIGMAR1 3281/4885MEN1 748/4885KMT2A 3527/4885

“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.