SCHEMBL3405646

SCHEMBL3405646

CCOC(=O)CC(=O)c1cnc(C)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 2/20 0.46
KMT2A Q03164 1/20 0.46
MGAM O43451 1/20 0.45
GAA P10253 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL4929216 0.85 POLB (0.49) POLBL3MBTL1LMNAKMT2AKDM4E
SCHEMBL509740 0.84 SIRT6 (0.46) L3MBTL1KMT2AMGAMGAASI
SCHEMBL1644521 0.79 POLB (0.70) POLBL3MBTL1LMNAKMT2AALDH1A1
SCHEMBL2218231 0.79 L3MBTL1 (0.62) POLBL3MBTL1LMNAKMT2AALDH1A1
SCHEMBL11720926 0.79 GAA (0.44) KMT2AMGAMGAASIMGAM2
SCHEMBL509677 0.79 POLB (0.52) POLBKMT2AKDM4EMAPTHPGD
SCHEMBL10072456 0.78 POLB (0.50) POLBL3MBTL1LMNAKMT2AGAA
SCHEMBL15176143 0.78 KDM4E (0.44) POLBKMT2AMGAMGAASI
SCHEMBL5269058 0.77 POLB (0.46) POLBL3MBTL1LMNAKMT2AGAA
SCHEMBL23013933 0.76 CXCR1 (0.43) POLBL3MBTL1LMNAKMT2AMGAM

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-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 EP disclosed
EP-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 EP disclosed
WO-2008152418-A1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2008-12-18 WO disclosed
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-4144339-A TREATMENT OF BILHARZIASIS RHONE-POULENC INDUSTRIES (FR) 1979-03-13 US disclosed
US-4138487-A NEMATOCIDES RHONE-POULENC INDUSTRIES (FR) 1979-02-06 US disclosed
US-4110450-A BILHARZIASIS RHONE-POULENC INDUSTRIES (FR) 1978-08-29 US disclosed
US-4058611-A PYRAZINYL, BILHARZIASIS, AMOEBIASIS RHONE-POULENC INDUSTRIES (FR) 1977-11-15 US 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-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 NISCH, PIR, QDPR POLB 1019/4885L3MBTL1 4676/4885LMNA 2265/4885

“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.