SCHEMBL22279804

SCHEMBL22279804

CCOC(=O)[C@@H]1CNC(=O)[C@@H]1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.43
TSHR P16473 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NAAA Q02083 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
SCHEMBL22279878 1.00 PKM (0.46) PKMMAPTRAB9ATSHRMEN1
SCHEMBL20875895 0.86 NAAA (0.41) TSHRCYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL22279740 0.86 NAAA (0.41) TSHRCYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL20875888 0.82 CTRB1 (0.41) TSHRNAAA
SCHEMBL20875887 0.82 CTRB1 (0.41) TSHRNAAA
SCHEMBL8295083 0.82 CTRB1 (0.41) TSHRNAAA
SCHEMBL20875936 0.79 CTRB1 (0.39) NAAA
SCHEMBL22279590 0.78 MAPT (0.54) PKMMAPTRAB9ATSHRMEN1
SCHEMBL22279791 0.78 MAPT (0.54) PKMMAPTRAB9ATSHRMEN1
SCHEMBL20875879 0.78 MAPT (0.54) PKMMAPTRAB9ATSHRMEN1

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-11180479-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-11-23 US disclosed
US-20200239446-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2020-07-30 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 (2 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-11180479-B2 Antiviral compounds PLA2G1B, PLA2G4A, PLA2G4C PKM 3412/4885MAPT 4574/4885RAB9A 1423/4885
US-20200239446-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G4A, PLA2G4C PKM 3412/4885MAPT 4574/4885RAB9A 1423/4885

“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.