SCHEMBL8064563

SCHEMBL8064563

CC(C)N1CCC2(CC1)CO2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.41
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHRNA7 P36544 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL15960697 0.83 CYP2D6 (0.39) CYP2D6MEN1ALDH1A1KMT2ACHRNA7
SCHEMBL25081710 0.79 CYP2D6 (0.37) CYP2D6
SCHEMBL9963298 0.78 CYP2D6 (0.36) CYP2D6HRH3
SCHEMBL15960703 0.76 KCNH2 (0.41) CYP2D6HRH3
SCHEMBL12267734 0.76 CYP2D6 (0.35) CYP2D6HRH3
SCHEMBL24951670 0.76 CYP2D6 (0.35) CYP2D6HRH3
SCHEMBL15960718 0.75 CYP2D6 (0.33) CYP2D6
SCHEMBL22064017 0.74 CYP2D6 (0.34) CYP2D6MEN1ALDH1A1KMT2AKDM4E
SCHEMBL278248 0.73 POLB (0.40) CYP2D6ALDH1A1KMT2AMAPK1L3MBTL1
SCHEMBL12026662 0.73 CYP2D6 (0.39) CYP2D6MEN1ALDH1A1KMT2ACHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130005769-A1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 STORCK PIERRE HENRI (GB) 2013-01-03 US disclosed
US-20130005769-A1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 STORCK PIERRE HENRI (GB) 2013-01-03 US disclosed
US-8288377-B2 Inhibitors of the interaction between MDM2 and p53 JANSSEN PHARMACEUTICA N.V. (BE) 2012-10-16 US disclosed
US-8288377-B2 Inhibitors of the interaction between MDM2 and p53 JANSSEN PHARMACEUTICA N.V. (BE) 2012-10-16 US disclosed
EP-2203447-B1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 JANSSEN PHARMACEUTICA NV (BE) 2012-02-29 EP disclosed
US-20100216770-A1 Inhibitors of the Interaction Between MDM2 and P53 JANSSEN-CILAG (FR) 2010-08-26 US disclosed
US-20100216770-A1 Inhibitors of the Interaction Between MDM2 and P53 JANSSEN-CILAG (FR) 2010-08-26 US disclosed
WO-2009037343-A1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 JANSSEN PHARMACEUTICA NV (BE) 2009-03-26 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 (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-20100216770-A1 Inhibitors of the Interaction Between MDM2 and P53 TP53, MDM2, TP53BP1 CYP2D6 1222/4885MEN1 1788/4885ALDH1A1 3556/4885
US-20130005769-A1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 TP53, MDM2, TP53BP1 CYP2D6 1222/4885MEN1 1788/4885ALDH1A1 3556/4885

“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.