SCHEMBL5577466

SCHEMBL5577466

CC(=O)N(Cc1ccccc1C1CCN(Cc2ccc(F)cc2)CC1)c1cccc(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.52
SIGMAR1 Q99720 2/20 0.48
CCR5 P51681 6/20 0.47
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
GAA P10253 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
SCHEMBL5577631 0.91 ACHE (0.52) ACHESIGMAR1CCR5MEN1KMT2A
SCHEMBL5577665 0.91 ACHE (0.59) ACHESIGMAR1MEN1KMT2AGAA
SCHEMBL5577500 0.90 SIGMAR1 (0.48) ACHESIGMAR1CCR5MEN1KMT2A
SCHEMBL5577523 0.90 ACHE (0.56) ACHESIGMAR1MEN1KMT2AGAA
SCHEMBL5577870 0.89 SIGMAR1 (0.47) ACHESIGMAR1CCR5
SCHEMBL5577412 0.89 ACHE (0.60) ACHESIGMAR1MEN1KMT2AATM
SCHEMBL5577790 0.86 ACHE (0.56) ACHESIGMAR1MEN1KMT2AGAA
SCHEMBL5577885 0.85 SIGMAR1 (0.52) ACHESIGMAR1CCR5GAA
SCHEMBL5577437 0.84 ACHE (0.49) ACHESIGMAR1MEN1KMT2AATM
SCHEMBL5577775 0.84 ALDH1A1 (0.47) ACHESIGMAR1CCR5MEN1KMT2A

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 1504/4885SIGMAR1 3281/4885CCR5 183/4885

“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.