SCHEMBL4904945

SCHEMBL4904945

[CH2]c1ccc(OC(=O)C(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.66
LMNA P02545 1/20 0.42
CA2 P00918 1/20 0.39
RAB9A P51151 1/20 0.39
ALOX15 P16050 1/20 0.39
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGS2 P35354 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL21795326 0.89 ELANE (0.79) ELANELMNACA2RAB9AALOX15
SCHEMBL21325759 0.83 ELANE (0.70) ELANELMNACA2RAB9AALOX15
SCHEMBL891415 0.81 ELANE (0.68) ELANELMNAMEN1KMT2A
SCHEMBL5186261 0.81 ELANE (0.68) ELANELMNACA2MAPTMEN1
SCHEMBL12616903 0.81 ELANE (0.68) ELANELMNACA2RAB9AMEN1
SCHEMBL80751 0.80 LMNA (0.64) ELANELMNARAB9APOLBMAPT
SCHEMBL18211356 0.79 ELANE (0.66) ELANELMNARAB9AMAPTL3MBTL1
SCHEMBL4185924 0.79 ELANE (0.66) ELANELMNAMAPTMEN1KMT2A
SCHEMBL4683823 0.79 ELANE (0.66) ELANELMNACA2MAPTPKM
SCHEMBL12616891 0.79 ELANE (0.66) ELANELMNACA2RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655392-B1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA INC (US) 2018-04-18 EP disclosed
US-20170002037-A1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. 2017-01-05 US disclosed
US-9365605-B2 Cyclic nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2016-06-14 US disclosed
US-20140303108-A1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. 2014-10-09 US disclosed
EP-1765844-B1 PURINE NUCLEOTIDE DERIVATIVES SOLVELL AS (NO) 2014-07-30 EP disclosed
US-8772474-B2 Cyclic nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2014-07-08 US disclosed
EP-2655392-A1 CYCLIC NUCLEOTIDE ANALOGS Alios Biopharma, Inc. (US) 2013-10-30 EP disclosed
US-20120165286-A1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-06-28 US disclosed
WO-2012088155-A1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-06-28 WO disclosed
US-20080293665-A1 Purine Nucleotide Derivatives LAURAS AS (NO) 2008-11-27 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 (4 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-20140303108-A1 CYCLIC NUCLEOTIDE ANALOGS NT5C2, NTPCR, PNP ELANE 647/4885LMNA 1635/4885CA2 4055/4885
US-20080293665-A1 Purine Nucleotide Derivatives CGAS, PDE8A, PDE7A ELANE 3668/4885LMNA 1707/4885CA2 3412/4885
US-20170002037-A1 CYCLIC NUCLEOTIDE ANALOGS NT5C2, NTPCR, PNP ELANE 647/4885LMNA 1635/4885CA2 4055/4885
US-20120165286-A1 CYCLIC NUCLEOTIDE ANALOGS NT5C2, NTPCR, PNP ELANE 647/4885LMNA 1635/4885CA2 4055/4885

“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.