SCHEMBL2497223

SCHEMBL2497223

[N-]=[N+]=NP(=O)(Oc1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
SRC P12931 1/20 0.47
CA2 P00918 5/20 0.38
CA4 P22748 5/20 0.38
CA5A P35218 5/20 0.38
CA12 O43570 4/20 0.38
CA1 P00915 4/20 0.38
CA7 P43166 4/20 0.38
CA9 Q16790 4/20 0.38
CA5B Q9Y2D0 4/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 2/20 0.36
PKM P14618 1/20 0.36
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ANPEP P15144 1/20 0.35

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
SCHEMBL17305220 1.00 L3MBTL1 (0.50) L3MBTL1TDP1SRCCA2CA4
SCHEMBL27836558 0.79 SRC (0.52) L3MBTL1TDP1SRCKDM4EMEN1
SCHEMBL2303782 0.79 SRC (0.52) L3MBTL1TDP1SRCKDM4EMEN1
SCHEMBL80417 0.79 SRC (0.52) L3MBTL1TDP1SRCKDM4EMEN1
SCHEMBL873578 0.78 SRC (0.55) L3MBTL1TDP1SRCCA2CA4
SCHEMBL9911203 0.76 SRC (0.48) L3MBTL1TDP1SRCKDM4EMEN1
SCHEMBL25883278 0.76 SRC (0.48) L3MBTL1TDP1SRCKDM4EMEN1
SCHEMBL27881894 0.75 SRC (0.47) L3MBTL1TDP1SRCKDM4EMEN1
SCHEMBL8587398 0.74 L3MBTL1 (0.53) L3MBTL1TDP1SRCCA2CA4
Phosphoric Acid SCHEMBL29974621 0.74 SRC (0.46) L3MBTL1TDP1SRCCA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2948453-B1 PYRAZOLO[3,4-D]PYRIMIDINONE COMPOUNDS AS INHIBITORS OF THE P53/MDM2 INTERACTION NOVARTIS AG (CH) 2017-08-02 EP disclosed
US-9556180-B2 Pyrazolo[3,4-d]pyrimidinone compounds as inhibitors of the P53/MDM2 interaction NOVARTIS AG (CH) 2017-01-31 US disclosed
US-20150353563-A1 PYRAZOLO[3,4-D]PYRIMIDINONE COMPOUNDS AS INHIBITORS OF THE P53/MDM2 INTERACTION NOVARTIS PHARMA AG (CH) 2015-12-10 US disclosed
EP-2948453-A1 PYRAZOLO[3,4-D]PYRIMIDINONE COMPOUNDS AS INHIBITORS OF THE P53/MDM2 INTERACTION Novartis AG (CH) 2015-12-02 EP disclosed
WO-2014115080-A1 PYRAZOLO[3,4-D]PYRIMIDINONE COMPOUNDS AS INHIBITORS OF THE P53/MDM2 INTERACTION NOVARTIS AG (CH) 2014-07-31 WO disclosed
CN-101321736-B To M1Compounds with receptor activity and their use in medicine GLAXO GROUP LTD 2012-04-04 CN disclosed
US-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 US disclosed
CN-101321736-A To M1Compounds with receptor activity and their use in medicine GLAXO GROUP LTD (GB) 2008-12-10 CN disclosed
US-5698569-A Retroviral protease inhibitors G. D. SEARLE & CO. (US) 1997-12-16 US disclosed
US-5622949-A AIDS THERAPY G. D. SEARLE & CO. (US) 1997-04-22 US disclosed
US-5620977-A HUMAN IMMUNODEFICIENCY VIRUS G.D. SEARLE & CO. (US) 1997-04-15 US disclosed
US-5475013-A Inhibit human immunodeficiency virus protease MONSANTO COMPANY (US) 1995-12-12 US disclosed
EP-0047620-B1 ARYL DIAZABICYCLYL AMIDES, A PROCESS FOR THEIR PREPARATION AND USE BEECHAM GROUP PLC (GB) 1985-03-13 EP disclosed
EP-0047620-A1 Aryl diazabicyclyl amides, a process for their preparation and use BEECHAM GROUP PLC (GB) 1982-03-17 EP 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-20150353563-A1 PYRAZOLO[3,4-D]PYRIMIDINONE COMPOUNDS AS INHIBITORS OF THE P53/MDM2 INTERACTION TP53, MDM4, MDM2 L3MBTL1 1881/4885TDP1 124/4885SRC 2049/4885
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 L3MBTL1 2814/4885TDP1 1420/4885SRC 3839/4885

“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.