SCHEMBL2392460

SCHEMBL2392460

CC(C)(C)OC(=O)NC1CCC(CNc2ccc(Br)c(F)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.45
DRD3 P35462 2/20 0.42
KDM1A O60341 2/20 0.40
MAOB P27338 1/20 0.40
CRHR1 P34998 4/20 0.39
AAK1 Q2M2I8 1/20 0.37
CCRL2 O00421 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PBK Q96KB5 1/20 0.37
NAMPT P43490 1/20 0.37

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
SCHEMBL2392456 1.00 DRD2 (0.45) DRD2DRD3KDM1AMAOBCRHR1
SCHEMBL15342786 1.00 DRD2 (0.45) DRD2DRD3KDM1AMAOBCRHR1
SCHEMBL2390116 0.86 DRD2 (0.44) DRD2DRD3KDM1AMAOBAAK1
SCHEMBL2390121 0.86 DRD2 (0.44) DRD2DRD3KDM1AMAOBAAK1
SCHEMBL2393792 0.81 DRD2 (0.43) DRD2DRD3KDM1AMAOBCRHR1
SCHEMBL15342806 0.81 DRD2 (0.43) DRD2DRD3KDM1AMAOBCRHR1
SCHEMBL2393795 0.81 DRD2 (0.43) DRD2DRD3KDM1AMAOBCRHR1
SCHEMBL25042170 0.80 DRD2 (0.43) DRD2DRD3KDM1AMAOBCCRL2
SCHEMBL31206098 0.80 DRD2 (0.43) DRD2DRD3KDM1ACCRL2
SCHEMBL31206174 0.80 DRD2 (0.43) DRD2DRD3KDM1ACCRL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051279-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2015-06-09 US disclosed
EP-2516009-B1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2014-09-24 EP disclosed
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2013-10-24 US disclosed
US-8440693-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2013-05-14 US disclosed
EP-2516009-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES Novartis AG (CH) 2012-10-31 EP disclosed
US-20110230457-A1 Substituted Isoquinolinones and Quinazolinones NOVARTIS AG (CH) 2011-09-22 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-20110230457-A1 Substituted Isoquinolinones and Quinazolinones MDM4, MDM2, TP53 DRD2 1974/4885DRD3 2076/4885KDM1A 1216/4885
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES MDM4, MDM2, TP53 DRD2 1974/4885DRD3 2076/4885KDM1A 1216/4885

“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.