SCHEMBL6163608

SCHEMBL6163608

CC(C)(C)OC(=O)CC(=O)c1cccc(-c2ccnn2CCOC2CCCCO2)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MET P08581 3/20 0.35
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
PIK3CD O00329 5/20 0.34
PLK1 P53350 1/20 0.34
P2RX3 P56373 1/20 0.33
EP300 Q09472 1/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL6610013 0.89 MEN1 (0.41) USP30MEN1KMT2AMETDRD2
SCHEMBL6167215 0.87 PDE4D (0.44) MEN1KMT2AMETKDM4CP2RX3
SCHEMBL6167571 0.86 MEN1 (0.49) MEN1KMT2AMETKDM4CPIK3CD
SCHEMBL6164800 0.82 USP30 (0.37) USP30DRD2DRD3EP300CREBBP
SCHEMBL6164819 0.80 PLK1 (0.31) KMT2AMETPLK1
SCHEMBL6164557 0.80 USP30 (0.36) USP30MEN1KMT2AKDM4CEP300
SCHEMBL5557855 0.79 USP30 (0.38) USP30MEN1KMT2AKDM4CEP300
SCHEMBL6165685 0.79 RAB9A (0.40) USP30MEN1KMT2AKDM4C
SCHEMBL6165934 0.78 CTSV (0.44) DRD2DRD3
SCHEMBL6166564 0.78 KDM4C (0.37) USP30MEN1KMT2AKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379511-B1 DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II HOFFMANN LA ROCHE (CH) 2005-07-20 EP disclosed
US-6544985-B2 For therapy of acute and/or chronic neurological disorders such as psychosis, schizophrenia, Alzheimer's disease, cognitive disorders and memory deficits HOFFMAN-LA ROCHE INC. 2003-04-08 US disclosed
US-20020193367-A1 Dihydro-benzo [b] [1,4] diazepin-2-one derivatives F. HOFFMAN-LA ROCHE AG A SWISS COMPANY (CH) 2002-12-19 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-20020193367-A1 Dihydro-benzo [b] [1,4] diazepin-2-one derivatives CYP1B1, GRIN2B, BDKRB1 USP30 4156/4885MEN1 1887/4885KMT2A 1244/4885

“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.