SCHEMBL5483803

SCHEMBL5483803

CN(C)C1CCN(c2ccc(C(N)=O)cc2)C1.CN(C)C1CCN(c2ccc(NC(=O)c3ccc(Br)c(F)c3)cc2)C1.CN(C)C1CCN(c2ccc(NC(=O)c3ccc(I)cc3)cc2)C1.CN(C)[C@@H]1CCN(c2ccc(NC(=O)c3ccc(I)cc3)cc2F)C1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.51
FPR1 P21462 1/20 0.43
FPR2 P25090 1/20 0.43
WDR5 P61964 1/20 0.42
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
CSF1R P07333 1/20 0.39
HTR1B P28222 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
SCHEMBL2637447 1.00 MCHR1 (0.51) MCHR1FPR1FPR2WDR5MEN1
SCHEMBL1749130 0.85 MCHR1 (0.54) MCHR1FPR1FPR2WDR5CSF1R
SCHEMBL1749786 0.85 MCHR1 (0.65) MCHR1MEN1LMNAMAPTKMT2A
SCHEMBL1749132 0.85 MCHR1 (0.54) MCHR1FPR1FPR2WDR5CSF1R
SCHEMBL1750121 0.80 MCHR1 (0.76) MCHR1KMT2A
SCHEMBL1750166 0.80 MCHR1 (0.62) MCHR1FPR1FPR2MEN1LMNA
SCHEMBL1750191 0.78 MCHR1 (0.55) MCHR1FPR1FPR2WDR5
SCHEMBL1750189 0.78 MCHR1 (0.55) MCHR1FPR1FPR2WDR5
SCHEMBL12530743 0.77 MCHR1 (0.68) MCHR1CSF1R
SCHEMBL2636922 0.75 GAA (0.48) MCHR1FPR1FPR2WDR5MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-09-06 US 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-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 MCHR1 2068/4885FPR1 586/4885FPR2 782/4885

“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.