SCHEMBL22036337

SCHEMBL22036337

C=C(C)Oc1ccc(-c2cnc(CN(C)C)n2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
GAA P10253 7/20 0.34
THRB P10828 1/20 0.34
ALOX15 P16050 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 3/20 0.33
USP2 O75604 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2D6 P10635 2/20 0.31
ACHE P22303 1/20 0.31
CYP3A4 P08684 1/20 0.31
FYN P06241 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL23723822 0.80 FYN (0.38) MAPTKMT2AMEN1GAATP53
SCHEMBL21978577 0.74 ALDH1A1 (0.46) MAPTKMT2AMEN1GAATDP1
SCHEMBL21994321 0.71 GAA (0.33) MAPTKMT2AMEN1GAATHRB
SCHEMBL22035323 0.71 SLC6A4 (0.38) MAPTKMT2AMEN1GAAHTT
SCHEMBL21994667 0.71 SLC6A2 (0.37) MAPTKMT2AMEN1GAATP53
SCHEMBL21979061 0.70 GAA (0.35) MAPTKMT2AMEN1GAATHRB
SCHEMBL22035786 0.69 PCSK9 (0.37) MAPTKMT2AMEN1GAATP53
SCHEMBL21978585 0.67 FYN (0.32) FYN
SCHEMBL2825283 0.66 ALDH1A1 (0.40) MAPTKMT2AMEN1ALOX15TDP1
SCHEMBL21978268 0.65 P4HTM (0.41) KMT2AMEN1TP53KDM4EALDH1A1

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-11026993-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders NOVARTIS AG (CH) 2021-06-08 US disclosed
US-20200164024-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2020-05-28 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-11026993-B2 Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (PCSK9) inhibitors for the treatment of metabolic disorders PCSK9, PCSK7, PCSK6 MAPT 114/4885KMT2A 2933/4885MEN1 337/4885
US-20200164024-A1 CYCLIC TETRAMER COMPOUNDS AS PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) INHIBITORS FOR THE TREATMENT OF METABOLIC DISORDERS PCSK9, PCSK7, PCSK6 MAPT 114/4885KMT2A 2933/4885MEN1 337/4885

“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.