SCHEMBL6606419

SCHEMBL6606419

COc1cnc(CC#N)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 13/20 0.36
TP53 P04637 1/20 0.36
SRC P12931 2/20 0.35
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 1/20 0.35
CHEK1 O14757 1/20 0.34
PDE5A O76074 1/20 0.34

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
SCHEMBL15142441 0.80 AXL (0.35) MDM2KDM4EALDH1A1HTTHPGD
SCHEMBL6607812 0.79 NPC1 (0.38) KDM4EALDH1A1HTTHPGD
SCHEMBL12467200 0.79 PGK1 (0.40) KDM4EALDH1A1HTTHPGD
SCHEMBL30716907 0.79 NPC1 (0.38) KDM4EALDH1A1HTTHPGD
SCHEMBL6608302 0.78 KDM4E (0.36) MDM2TP53KDM4EALDH1A1HTT
SCHEMBL6606573 0.75 PDE3B (0.36) SRC
SCHEMBL6606814 0.74 MDM2 (0.32) MDM2TP53KDM4EALDH1A1HTT
SCHEMBL28015248 0.72 NPC1 (0.42) KDM4EALDH1A1HPGD
SCHEMBL24529326 0.72 HTR1A (0.43) TP53KDM4EALDH1A1
SCHEMBL15142051 0.72 GAA (0.42) KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3272754-B1 IMIDAZOPYRROLIDINONE COMPOUNDS NOVARTIS AG (CH) 2019-05-29 EP disclosed
EP-3272754-A1 IMIDAZOPYRROLIDINONE COMPOUNDS Novartis AG (CH) 2018-01-24 EP disclosed
EP-3064502-A1 IMIDAZOPYRROLIDINONE COMPOUNDS Novartis AG (CH) 2016-09-07 EP disclosed
CN-104203952-A Imidazopyrrolidinone compounds NOVARTIS AG 2014-12-10 CN disclosed
EP-2807164-A1 IMIDAZOPYRROLIDINONE COMPOUNDS Novartis AG (CH) 2014-12-03 EP disclosed
US-20140343084-A1 IMIDAZOPYRROLIDINONE COMPOUNDS NOVARTIS AG (CH) 2014-11-20 US disclosed
US-8815926-B2 Substituted pyrrolo[3,4-D]imidazoles for the treatment of MDM2/4 mediated diseases NOVARTIS AG (CH) 2014-08-26 US disclosed
US-20140011798-A1 IMIDAZOPYRROLIDINONE COMPOUNDS NOVARTIS AG (CH) 2014-01-09 US disclosed
WO-2013111105-A1 IMIDAZOPYRROLIDINONE COMPOUNDS NOVARTIS AG (CH) 2013-08-01 WO disclosed
EP-0882714-B1 SUBSTITUTED VINYLPYRIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SS PHARMACEUTICAL CO (JP) 2004-03-03 EP disclosed
US-5935977-A PHOSPHODIESTERASE IV INHIBITORS, TUMOR NECROSIS FACTOR-ALPHA PRODUCTION INHIBITORS; TREATING INFLAMMATORY AND AUTOIMMUNE DISEASES SS PHARMACEUTICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0882714-A1 SUBSTITUTED VINYLPYRIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SS Pharmaceutical Co., Ltd. (JP) 1998-12-09 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-20140011798-A1 IMIDAZOPYRROLIDINONE COMPOUNDS MDM4, MDM2, TP53 MDM2 2/4885TP53 3/4885SRC 2040/4885
US-20140343084-A1 IMIDAZOPYRROLIDINONE COMPOUNDS MDM4, MDM2, TP53 MDM2 2/4885TP53 3/4885SRC 2040/4885

“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.