SCHEMBL20438092

SCHEMBL20438092

CC(C)(C)OC(=O)NCc1cc(=O)c2cc(-c3cn(Cc4ccccc4)nn3)ccc2o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.48
▸ CDC7 O00311 12/20 0.47
▸ MAOB P27338 3/20 0.44
▸ HIPK2 Q9H2X6 5/20 0.44
▸ DAPK3 O43293 4/20 0.44
▸ CLK2 P49760 4/20 0.44
▸ CDK5 Q00535 4/20 0.44
▸ DYRK1A Q13627 4/20 0.44
▸ PIM1 P11309 4/20 0.44
▸ CDK2 P24941 4/20 0.44
▸ GSK3B P49841 4/20 0.44
▸ CLK4 Q9HAZ1 4/20 0.44
▸ PAK4 O96013 3/20 0.44
▸ PRKX P51817 3/20 0.44
▸ MELK Q14680 3/20 0.44
▸ MAPK13 O15264 3/20 0.44
▸ ROCK2 O75116 3/20 0.44
▸ PRKD3 O94806 3/20 0.44
▸ CDK1 P06493 3/20 0.44
▸ PRKACA P17612 3/20 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
SCHEMBL18397914 0.88 LOXL2 (0.54) LOXL2CDC7MAOBHIPK2DAPK3
SCHEMBL20438090 0.87 LOXL2 (0.64) LOXL2MAOBHDAC3HDAC4HDAC1
SCHEMBL20438089 0.87 LOXL2 (0.43) LOXL2HDAC3HDAC1HDAC2HDAC10
SCHEMBL20438087 0.85 LOXL2 (0.48) LOXL2DYRK1AGSK3BPDPK1
SCHEMBL20438091 0.85 LOXL2 (0.48) LOXL2CDC7MAOBPDPK1
SCHEMBL20438076 0.81 BCHE (0.47) HDAC1
SCHEMBL20438084 0.81 BCHE (0.46) LOXL2PDPK1AKT1
SCHEMBL18664515 0.80 MEN1 (0.55) CDC7HDAC3HDAC4HDAC1HDAC7
SCHEMBL20438101 0.80 P2RY14 (0.43) HDAC3HDAC1HDAC2HDAC10HDAC8
SCHEMBL18397889 0.80 LOXL2 (0.70) LOXL2CDC7HIPK2DAPK3CLK2

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-20180215727-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. 2018-08-02 — — US disclosed
US-20180215727-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. 2018-08-02 — — 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-20180215727-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX LOXL2 1/4885CDC7 4449/4885MAOB 62/4885

“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.

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