SCHEMBL8264773

SCHEMBL8264773

CC(NCCCCO)c1cc(Cl)ccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RRM1 P23921 1/20 0.41
▸ CXCR2 P25025 2/20 0.37
▸ CX3CR1 P49238 2/20 0.37
▸ KDM4C Q9H3R0 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ MAPK1 P28482 3/20 0.35
▸ CDK5 Q00535 2/20 0.35
▸ CDK5R1 Q15078 2/20 0.35
▸ CCR1 P32246 1/20 0.35
▸ HTT P42858 2/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CDK1 P06493 3/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KMT2A Q03164 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
SCHEMBL8264800 0.90 CXCR2 (0.39) CXCR2CX3CR1KDM4CALDH1A1MAPK1
SCHEMBL12845766 0.80 SIGMAR1 (0.51) —
SCHEMBL12845661 0.79 KDM4C (0.38) CXCR2CX3CR1KDM4CALDH1A1MAPK1
SCHEMBL18475372 0.78 KDM4C (0.41) CXCR2CX3CR1KDM4CALDH1A1MAPK1
SCHEMBL8264519 0.77 MAPT (0.42) CXCR2CX3CR1KDM4CALDH1A1MAPK1
SCHEMBL8264471 0.76 CCNC (0.46) —
SCHEMBL8265697 0.73 KDM4C (0.41) CXCR2CX3CR1KDM4CALDH1A1MAPK1
SCHEMBL12845425 0.72 POLB (0.44) CYP1A2CYP2D6CYP2C19SMN1; SMN2
SCHEMBL18700479 0.70 KDM4C (0.36) CXCR2CX3CR1KDM4CALDH1A1LMNA
SCHEMBL12782123 0.69 L3MBTL1 (0.47) HTTLMNAMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404683-B2 Inhibitors of the interaction between MDM2 and P53 JANSSEN PHARMACEUTICAL N.V. (BE) 2013-03-26 — — US disclosed
US-20110053937-A1 Inhibitors of the Interaction Between MDM2 and P53 LACRAMPE JEAN FERNAND ARMAND 2011-03-03 — — US disclosed
US-7834016-B2 Inhibitors of the interaction between MDM2 and p53 JANSSEN PHARMACEUTICA NV (BE) 2010-11-16 — — US disclosed
US-7834016-B2 Inhibitors of the interaction between MDM2 and p53 JANSSEN PHARMACEUTICA NV (BE) 2010-11-16 — — US disclosed
US-20080039472-A1 Inhibitors of the Interaction Between Mdm2 and P53 JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-14 — — US disclosed
US-20080039472-A1 Inhibitors of the Interaction Between Mdm2 and P53 JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-14 — — US disclosed
WO-2006032631-A1 INHIBITORS OF THE INTERACTION BETWEEN MDM2 AND P53 JANSSEN PHARMACEUTICA N.V. (BE) 2006-03-30 — — 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-20110053937-A1 Inhibitors of the Interaction Between MDM2 and P53 TP53, MDM2, TP53BP1 RRM1 122/4885CXCR2 2298/4885CX3CR1 3305/4885
US-20080039472-A1 Inhibitors of the Interaction Between Mdm2 and P53 TP53, MDM2, TP53BP1 RRM1 122/4885CXCR2 2298/4885CX3CR1 3305/4885

“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.

Send feedback