SCHEMBL5740608

SCHEMBL5740608

CCOC(=O)Cc1cn(C(=O)OC(C)(C)C)c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 1.00
EPHX1 P07099 1/20 0.50
PDE10A Q9Y233 1/20 0.46
PKM P14618 1/20 0.45
HTR6 P50406 1/20 0.45
MAPT P10636 1/20 0.44
CREBBP Q92793 1/20 0.44
ADAM17 P78536 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ACHE P22303 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PIM1 P11309 1/20 0.41
MARK3 P27448 1/20 0.41
MAP4K2 Q12851 1/20 0.41
CAMK2B Q13554 1/20 0.41
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41

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
SCHEMBL2018732 0.88 L3MBTL1 (0.78) L3MBTL1EPHX1PDE10AHTR6MAPT
SCHEMBL29651147 0.88 L3MBTL1 (0.78) L3MBTL1EPHX1PDE10AHTR6MAPT
SCHEMBL9685932 0.87 L3MBTL1 (0.77) L3MBTL1EPHX1PDE10AHTR6ADAM17
SCHEMBL360344 0.86 L3MBTL1 (0.76) L3MBTL1PKMMAPTCREBBPSMN1; SMN2
SCHEMBL10088115 0.86 L3MBTL1 (0.74) L3MBTL1EPHX1PDE10AHTR6CREBBP
SCHEMBL21457953 0.85 L3MBTL1 (0.73) L3MBTL1EPHX1PDE10AHTR6CREBBP
SCHEMBL21457951 0.85 L3MBTL1 (0.73) L3MBTL1EPHX1PDE10AHTR6CREBBP
SCHEMBL21457952 0.85 L3MBTL1 (0.73) L3MBTL1EPHX1PDE10AHTR6CREBBP
SCHEMBL2882457 0.85 L3MBTL1 (0.73) L3MBTL1EPHX1PDE10AHTR6ADAM17
SCHEMBL12572728 0.85 L3MBTL1 (0.73) L3MBTL1EPHX1PDE10AHTR6CREBBP

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563567-B2 Substituted heterocyclic compounds ARQULE, INC. (US) 2013-10-22 US disclosed
US-20060063760-A1 Hydroxamic acids useful in the treatment of hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-03-23 US disclosed
EP-1620397-A1 HYDROXAMIC ACIDS USEFUL IN THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS Bayer Pharmaceuticals Corporation (US) 2006-02-01 EP disclosed
WO-2004094376-A1 HYDROXAMIC ACIDS USEFUL IN THE TREATMENT OF HYPER-PROLIFERATIVE DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2004-11-04 WO 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-20060063760-A1 Hydroxamic acids useful in the treatment of hyper-proliferative disorders MKI67, PCNA, CCNA1 L3MBTL1 3995/4885EPHX1 1866/4885PDE10A 3931/4885

“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.