SCHEMBL4575653

SCHEMBL4575653

CCOP(=O)(COCC(C(=O)O)N(C(=O)OC)C1c2ccccc2-c2ccccc21)OCC

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ POLB P06746 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ PPARG P37231 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL4575935 0.84 MAPT (0.33) MAPTMAPK1POLBSMN1; SMN2CYP1A2
SCHEMBL30510335 0.82 CYP1A2 (0.38) MAPTMAPK1POLBCYP1A2TSHR
SCHEMBL8812896 0.82 CYP1A2 (0.38) MAPTMAPK1POLBCYP1A2TSHR
SCHEMBL4599750 0.81 CYP1A2 (0.38) MAPTPOLBCYP1A2TSHRPPARG
SCHEMBL1405873 0.81 CYP1A2 (0.38) MAPTPOLBCYP1A2TSHRPPARG
SCHEMBL1405820 0.81 CYP1A2 (0.38) MAPTPOLBCYP1A2TSHRPPARG
SCHEMBL30510259 0.81 CYP1A2 (0.38) MAPTPOLBCYP1A2TSHRPPARG
SCHEMBL25177901 0.79 SLC6A4 (0.36) MAPTPOLBSMN1; SMN2CYP1A2TSHR
SCHEMBL30510240 0.79 SLC6A4 (0.36) MAPTPOLBSMN1; SMN2CYP1A2TSHR
SCHEMBL25177898 0.79 CYP1A2 (0.37) MAPTPOLBCYP1A2TSHRPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194524-A1 Compounds For the Inhibition of Undesired Cell Proliferation and Use Thereof JERINI AG (DE) 2008-08-14 — — US disclosed
EP-1703912-A1 COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF Jerini AG (DE) 2006-09-27 — — EP disclosed
WO-2005063259-A1 COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF JERINI AG (DE) 2005-07-14 — — 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-20080194524-A1 Compounds For the Inhibition of Undesired Cell Proliferation and Use Thereof CCNB1, CCNB2, CCNA1 MAPT 1983/4885MAPK1 219/4885POLB 449/4885

“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