SCHEMBL4913985

SCHEMBL4913985

CCCN1C(=O)c2ccccc2C1(SCc1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 18/20 0.61
TP53 P04637 5/20 0.51
CYP2D6 P10635 2/20 0.48
CYP3A4 P08684 1/20 0.48

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
SCHEMBL4913982 1.00 MDM2 (0.61) MDM2TP53CYP2D6CYP3A4
SCHEMBL12083976 0.91 MDM2 (0.54) MDM2TP53CYP2D6CYP3A4
SCHEMBL4912401 0.89 MDM2 (0.62) MDM2TP53CYP2D6CYP3A4
SCHEMBL4912405 0.89 MDM2 (0.62) MDM2TP53CYP2D6CYP3A4
SCHEMBL18568903 0.81 MDM2 (0.54) MDM2TP53
SCHEMBL1826342 0.76 MDM2 (1.00) MDM2TP53CYP2D6CYP3A4
SCHEMBL4907072 0.76 MDM2 (1.00) MDM2TP53CYP2D6CYP3A4
SCHEMBL1821009 0.76 MDM2 (0.72) MDM2TP53CYP2D6CYP3A4
SCHEMBL8272069 0.76 MDM2 (0.74) MDM2TP53
SCHEMBL12017323 0.76 MDM2 (0.74) MDM2TP53

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 9 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
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 MDM2 1568/4885TP53 2490/4885CYP2D6 82/4885

“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.