SCHEMBL5577436

SCHEMBL5577436

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

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
CHRM3 P20309 6/20 0.46
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 1/20 0.41
NAMPT P43490 1/20 0.41
DRD3 P35462 1/20 0.40
TNF P01375 1/20 0.40
NOD2 Q9HC29 1/20 0.40
NOD1 Q9Y239 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
F10 P00742 1/20 0.40
PARP1 P09874 1/20 0.39
KLKB1 P03952 1/20 0.39
KLK1 P06870 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 0.92 CHRM3 (0.51) CHRM3LMNAKDM4EMEN1MAPT
SCHEMBL5577708 0.89 CHRM3 (0.54) MAPK1CHRM3LMNAKDM4EMEN1
SCHEMBL5577772 0.88 KDM4E (0.54) MAPK1CHRM3LMNAKDM4EMEN1
SCHEMBL5577765 0.87 CHRM3 (0.47) CHRM3LMNAKDM4EMEN1MAPT
SCHEMBL5577813 0.87 CHRM3 (0.58) MAPK1CHRM3
SCHEMBL5577883 0.85 CHRM3 (0.55) CHRM3LMNAKDM4EMEN1MAPT
SCHEMBL5577409 0.84 MAPK1 (0.63) MAPK1CHRM3LMNAKDM4EMEN1
SCHEMBL5577404 0.84 CHRM3 (0.50) MAPK1CHRM3LMNAKDM4ETNF
SCHEMBL5577268 0.83 CHRM3 (0.49) MAPK1CHRM3KDM4EMEN1KMT2A
SCHEMBL5577472 0.83 CHRM3 (0.58) MAPK1CHRM3LMNAKDM4EMEN1

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 MAPK1 592/4885CHRM3 2099/4885LMNA 4819/4885

“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.