SCHEMBL16467906

SCHEMBL16467906

COc1ccccc1OCCN(Cc1cccc(N)c1)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HDAC1 Q13547 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC2 Q92769 1/20 0.37
NCOR2 Q9Y618 1/20 0.37
PTGES O14684 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
ITGA4 P13612 1/20 0.36

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
SCHEMBL16468251 0.86 HDAC1 (0.43) HDAC1HDAC3HDAC2NCOR2PTGES
SCHEMBL16468482 0.86 L3MBTL1 (0.42) LMNASMN1; SMN2MRGPRX4KDM4EPTGES
SCHEMBL16468158 0.86 F2 (0.43) LMNAKDM4EHDAC1HDAC3HDAC2
SCHEMBL15264904 0.86 LMNA (0.46) LMNASMN1; SMN2MRGPRX4KDM4EPTGES
SCHEMBL16468138 0.85 SLC2A1 (0.41) LMNAMRGPRX4KDM4EMTNR1AMTNR1B
SCHEMBL16468182 0.85 HTR1A (0.48) LMNASMN1; SMN2KDM4EMAPT
SCHEMBL16468447 0.82 DRD4 (0.40) LMNAKDM4EHDAC1MAPT
SCHEMBL16468164 0.82 F2 (0.43) SMN1; SMN2KDM4EHDAC1L3MBTL1MAPT
SCHEMBL16468243 0.82 CHRNB2 (0.47) KDM4EHDAC1HDAC3HDAC2NCOR2
SCHEMBL16467917 0.82 MTNR1A (0.45) LMNAHDAC1HDAC3HDAC2NCOR2

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-20150051257-A1 SULPHONAMIDE DERIVATIVES OF BENZYLAMINE FOR THE TREATMENT OF CNS DISEASES ADAMED SP. ZO.O (PL) 2015-02-19 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-20150051257-A1 SULPHONAMIDE DERIVATIVES OF BENZYLAMINE FOR THE TREATMENT OF CNS DISEASES AQP4, BCL6, STS LMNA 3042/4885SMN1; SMN2 193/4885MRGPRX4 2577/4885

“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.