SCHEMBL5577340

SCHEMBL5577340

COc1ccc(CN2CC=C(c3cccc(CNC(=O)c4ccc(F)cc4)c3)CC2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CHRM3 P20309 8/20 0.49
LMNA P02545 2/20 0.48
CCR3 P51677 1/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL5577397 0.93 ALDH1A1 (0.55) MEN1KMT2ACHRM3ALDH1A1POLB
SCHEMBL5577388 0.89 CHRM3 (0.60) MEN1KMT2ACHRM3LMNA
SCHEMBL5577722 0.86 SMN1; SMN2 (0.55) CHRM3ALDH1A1SMN1; SMN2
SCHEMBL5577458 0.85 CHRM3 (0.61) MEN1KMT2ACHRM3ALDH1A1SMN1; SMN2
SCHEMBL5577493 0.85 SMN1; SMN2 (0.58) CHRM3LMNAALDH1A1SMN1; SMN2
SCHEMBL5577732 0.85 CHRM3 (0.65) MEN1KMT2ACHRM3LMNA
SCHEMBL5577409 0.84 MAPK1 (0.63) MEN1KMT2ACHRM3LMNAALDH1A1
SCHEMBL5577743 0.84 MEN1 (0.54) MEN1KMT2ACHRM3ALDH1A1POLB
SCHEMBL5577540 0.84 CHRM3 (0.51) MEN1KMT2ACHRM3
SCHEMBL5577909 0.83 SMN1; SMN2 (0.52) CHRM3LMNAALDH1A1SMN1; SMN2

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 MEN1 748/4885KMT2A 3527/4885CHRM3 2099/4885

“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.