SCHEMBL9259639

SCHEMBL9259639

CCOC(=O)C1OCCCO1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
ALDH1A1 P00352 5/20 0.38
TSHR P16473 3/20 0.37
LMNA P02545 3/20 0.37
POLB P06746 2/20 0.37
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 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
SCHEMBL4914137 0.91 PPM1B (0.43) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL24517229 0.76 PPM1B (0.42) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL8627456 0.76 HPGD (0.50) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL8626242 0.76 HPGD (0.50) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL1813924 0.76 HPGD (0.50) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL15188665 0.76 PPM1B (0.35) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL29102252 0.75 PPM1B (0.41) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL13556317 0.75 ALDH1A1 (0.45) ALDH1A1TSHRLMNAPOLBCYP1A2
SCHEMBL4911523 0.75 HPGD (0.46) PPM1BPTPN1PPP1CCALDH1A1TSHR
SCHEMBL30289815 0.75 HPGD (0.46) PPM1BPTPN1PPP1CCALDH1A1TSHR

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
WO-2022125849-A1 PROGRANULIN MODULATORS AND METHODS OF USING THE SAME ARKUDA THERAPEUTICS (US) 2022-06-16 WO disclosed
CN-106243080-B Method for producing carbonyl compound by decarboxylation DIC株式会社 2021-02-12 CN disclosed
US-20130096103-A1 IMIDAZOQUINOLINE COMPOUNDS NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2013-04-18 US disclosed
US-20130096103-A1 IMIDAZOQUINOLINE COMPOUNDS NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2013-04-18 US disclosed
US-20110217323-A1 IMIDAZOQUINOLINE COMPOUNDS NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2011-09-08 US disclosed
US-20080213308-A1 Imidazoquinoline Compounds NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2008-09-04 US disclosed
US-5466708-A Carbamyloxyoxetanone compounds HOFFMANN-LA ROCHE INC. (US) 1995-11-14 US disclosed
US-5376674-A Lipase inhibitors HOFFMAN-LA ROCHE INC. (US) 1994-12-27 US disclosed
US-5260310-A Oxetanone compounds and pharmaceutical compositions containing them HOFFMANN-LA ROCHE INC. (US) 1993-11-09 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 (3 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-20130096103-A1 IMIDAZOQUINOLINE COMPOUNDS IFNG, IRF3, MYD88 PPM1B 1794/4885PTPN1 1227/4885PPP1CC 3286/4885
US-20110217323-A1 IMIDAZOQUINOLINE COMPOUNDS IFNG, IRF3, MYD88 PPM1B 1794/4885PTPN1 1227/4885PPP1CC 3286/4885
US-20080213308-A1 Imidazoquinoline Compounds IFNG, IRF3, MYD88 PPM1B 1794/4885PTPN1 1227/4885PPP1CC 3286/4885

“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.