SCHEMBL18878470

SCHEMBL18878470

COC(=O)C(CCNC(=O)OC(C)(C)C)NC(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
NPSR1 Q6W5P4 6/20 0.48
MAPT P10636 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 1/20 0.47
PAX8 Q06710 1/20 0.47
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
IDO1 P14902 1/20 0.46
ATM Q13315 1/20 0.45
CTSK P43235 1/20 0.45
KLK5 Q9Y337 1/20 0.45
GAA P10253 1/20 0.45
RAB9A P51151 1/20 0.45
JAK3 P52333 1/20 0.44
BTK Q06187 1/20 0.44
CYP26A1 O43174 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
SCHEMBL10331448 0.87 KMT2A (0.47) MAPTTDP1MEN1KMT2AALDH1A1
SCHEMBL17203014 0.86 TDP1 (0.47) CA1CA2NPSR1MAPTTDP1
SCHEMBL17203015 0.86 TDP1 (0.47) CA1CA2NPSR1MAPTTDP1
SCHEMBL27793135 0.85 CA1 (0.52) CA1CA2NPSR1MAPTTDP1
SCHEMBL12708216 0.85 KCNA5 (0.46) CA1CA2NPSR1MAPTTDP1
SCHEMBL14561127 0.83 SYK (0.61) CA1CA2MAPTALDH1A1IDO1
SCHEMBL14090964 0.82 NPSR1 (0.50) CA1CA2NPSR1MAPTTDP1
SCHEMBL22312097 0.82 NPSR1 (0.59) CA1CA2NPSR1MAPTTDP1
SCHEMBL6862461 0.82 NPSR1 (0.54) CA1CA2NPSR1MAPTTDP1
SCHEMBL17550410 0.82 NPSR1 (0.54) CA1CA2NPSR1MAPTTDP1

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-20170144972-A1 METHODS OF LOWERING PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) CATABASIS PHARMACEUTICALS, INC. 2017-05-25 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-20170144972-A1 METHODS OF LOWERING PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) PCSK9, PCSK6, PCSK7 CA1 4129/4885CA2 2672/4885NPSR1 2352/4885

“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.