SCHEMBL4915352

SCHEMBL4915352

NCCN1C(=O)c2ccccc2C1(O)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.80
CYP3A4 P08684 1/20 0.80
MDM2 Q00987 14/20 0.61
KDM4E B2RXH2 1/20 0.52
RXFP1 Q9HBX9 1/20 0.50
ALDH1A1 P00352 2/20 0.47

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
SCHEMBL4915357 1.00 CYP2D6 (0.80) CYP2D6CYP3A4MDM2KDM4ERXFP1
SCHEMBL2548886 0.89 CYP2D6 (1.00) CYP2D6CYP3A4MDM2
SCHEMBL4907041 0.87 MDM2 (0.80) CYP2D6CYP3A4MDM2KDM4ERXFP1
SCHEMBL4907039 0.87 MDM2 (0.80) CYP2D6CYP3A4MDM2KDM4ERXFP1
SCHEMBL11755519 0.83 CYP2D6 (0.72) CYP2D6CYP3A4MDM2ALDH1A1
SCHEMBL18569303 0.82 MDM2 (0.61) CYP2D6CYP3A4MDM2KDM4ERXFP1
SCHEMBL6959754 0.81 CYP2D6 (0.70) CYP2D6CYP3A4MDM2KDM4ERXFP1
SCHEMBL4912136 0.81 MDM2 (0.84) CYP2D6MDM2ALDH1A1
SCHEMBL4912142 0.81 MDM2 (0.84) CYP2D6MDM2ALDH1A1
SCHEMBL6954914 0.80 MDM2 (0.72) CYP2D6CYP3A4MDM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786773-B1 ISOINDOLIN-1-ONE DERIVATIVES CANCER RES TECH LTD (GB) 2017-03-01 EP disclosed
EP-1786773-B1 ISOINDOLIN-1-ONE DERIVATIVES CANCER RES TECH LTD (GB) 2017-03-01 EP disclosed
US-8258175-B2 Prodrug; novel series of compounds which inhibit the MDM2-p53 interaction and have in vitro activity exerting an anti-tumour effect; cancer CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-09-04 US disclosed
US-8258175-B2 Prodrug; novel series of compounds which inhibit the MDM2-p53 interaction and have in vitro activity exerting an anti-tumour effect; cancer CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-09-04 US disclosed
US-8258175-B2 Prodrug; novel series of compounds which inhibit the MDM2-p53 interaction and have in vitro activity exerting an anti-tumour effect; cancer CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-09-04 US disclosed
US-20080261917-A1 Isoindolin-1-One Derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2008-10-23 US disclosed
US-20080261917-A1 Isoindolin-1-One Derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2008-10-23 US disclosed
US-20080261917-A1 Isoindolin-1-One Derivatives CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2008-10-23 US disclosed
EP-1786773-A1 ISOINDOLIN-1-ONE DERIVATIVES Cancer Research Technology Limited (GB) 2007-05-23 EP disclosed
WO-2006024837-A1 ISOINDOLIN-1-ONE DERIVATIVES CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-03-09 WO disclosed
WO-2006024837-A1 ISOINDOLIN-1-ONE DERIVATIVES CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-03-09 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-20080261917-A1 Isoindolin-1-One Derivatives HCN3, NHERF1, SIGMAR1 CYP2D6 82/4885CYP3A4 532/4885MDM2 1568/4885

“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.