SCHEMBL5577765

SCHEMBL5577765

Cc1ccccc1C(=O)NCc1cccc(C2=CCN(Cc3ccc(S(C)(=O)=O)cc3)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 6/20 0.47
LMNA P02545 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
NAMPT P43490 1/20 0.40
HTR6 P50406 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
PPARG P37231 2/20 0.40
DRD3 P35462 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
ELANE P08246 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
SCHEMBL5577789 0.91 CHRM3 (0.51) CHRM3LMNAKDM4EMAPTMEN1
SCHEMBL5577393 0.89 CHRM3 (0.55) CHRM3LMNAKDM4EMAPTMEN1
SCHEMBL5577436 0.87 MAPK1 (0.50) CHRM3LMNAKDM4EMAPTMEN1
SCHEMBL5577455 0.87 CHRM3 (0.57) CHRM3
SCHEMBL5577540 0.85 CHRM3 (0.51) CHRM3MEN1KMT2APKM
SCHEMBL5577883 0.84 CHRM3 (0.55) CHRM3LMNAKDM4EMAPTMEN1
SCHEMBL5577539 0.79 TAS1R3 (0.50) CHRM3KDM4EMAPTMEN1KMT2A
SCHEMBL5577666 0.77 CHRM3 (0.52) CHRM3LMNAKDM4EMAPTMEN1
SCHEMBL5577857 0.77 CHRM3 (0.52) CHRM3LMNAKDM4EMAPTMEN1
SCHEMBL5577729 0.76 CHRM3 (0.60) CHRM3LMNAKDM4EMAPTMEN1

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 CHRM3 2099/4885LMNA 4819/4885KDM4E 4213/4885

“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.