SCHEMBL1003356

SCHEMBL1003356

COc1c(C)c(C)c(C(N)=O)c(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.41
ALDH1A1 P00352 4/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
PTPN1 P18031 1/20 0.37
APOBEC3G Q9HC16 2/20 0.36
TSHR P16473 1/20 0.36
APOBEC3A P31941 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PARP1 P09874 1/20 0.35
PARP10 Q53GL7 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
PARP4 Q9UKK3 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL1004648 0.82 POLB (0.55) POLBALDH1A1KMT2AMEN1APOBEC3G
Hydrochloric Acid SCHEMBL29030889 0.79 POLB (0.52) POLBALDH1A1KMT2AMEN1APOBEC3G
SCHEMBL1003996 0.79 POLB (0.52) POLBALDH1A1KMT2AMEN1APOBEC3G
SCHEMBL9577000 0.77 PTPN1 (0.41) POLBALDH1A1KMT2AMEN1PTPN1
SCHEMBL7406703 0.76 POLB (0.50) POLBALDH1A1KMT2AMEN1APOBEC3G
SCHEMBL16781055 0.76 POLB (0.55) POLBALDH1A1KMT2AMEN1APOBEC3G
SCHEMBL2221293 0.73 POLB (0.52) POLBALDH1A1KMT2AMEN1APOBEC3G
SCHEMBL8874029 0.73 PTPN1 (0.38) POLBALDH1A1KMT2AMEN1PTPN1
SCHEMBL22923979 0.73 POLB (0.49) POLBKMT2AMEN1APOBEC3GTSHR
SCHEMBL2952712 0.72 ACHE (0.40) ALDH1A1KDM4ETDP1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778219-B2 Ionic liquids for separation of olefin-paraffin mixtures UT-BATTELLE, LLC (US) 2014-07-15 US disclosed
US-20130338389-A1 IONIC LIQUIDS FOR SEPARATION OF OLEFIN-PARAFFIN MIXTURES UT-BATTELLE, LLC (US) 2013-12-19 US disclosed
US-8535560-B2 Ionic liquids for separation of olefin-paraffin mixtures UT-BATTELLE, LLC (US) 2013-09-17 US disclosed
US-20110015461-A1 Ionic Liquids for Separation of Olefin-Paraffin Mixtures UT-BATTELLE, LLC (US) 2011-01-20 US disclosed
WO-2011008664-A2 IONIC LIQUIDS FOR SEPARATION OF OLEFIN-PARAFFIN MIXTURES UT-BATTELLE, LLC (US) 2011-01-20 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-20130338389-A1 IONIC LIQUIDS FOR SEPARATION OF OLEFIN-PARAFFIN MIXTURES POU2F1, POU2F2, POF1B POLB 2244/4885ALDH1A1 1816/4885KMT2A 3578/4885
US-20110015461-A1 Ionic Liquids for Separation of Olefin-Paraffin Mixtures POU2F1, POU2F2, POF1B POLB 2244/4885ALDH1A1 1816/4885KMT2A 3578/4885

“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.