SCHEMBL15071561

SCHEMBL15071561

CC[C@H]1OC(OC(=O)c2ccccc2)C(=O)[C@@H]1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS9 O00182 1/20 0.40
▸ LGALS1 P09382 1/20 0.40
▸ LGALS3 P17931 1/20 0.40
▸ LGALS7; LGALS7B P47929 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ BCHE P06276 3/20 0.36
▸ HTR3E A5X5Y0 1/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ CHRNA7 P36544 1/20 0.36
▸ HTR3A P46098 1/20 0.36
▸ HTR3D Q70Z44 1/20 0.36
▸ HTR3C Q8WXA8 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
SCHEMBL14616525 1.00 LGALS9 (0.40) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL15394247 1.00 LGALS9 (0.40) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL15071556 1.00 LGALS9 (0.40) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL12452534 0.86 ALDH1A1 (0.47) LMNAKMT2AHTTALDH1A1TSHR
SCHEMBL14929037 0.86 LMNA (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL18561531 0.86 LMNA (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL18671857 0.86 LMNA (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL38660515 0.76 LGALS9 (0.48) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL19866479 0.76 LGALS9 (0.49) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL12522983 0.75 TRPM8 (0.42) LMNAKMT2AMAPTHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9814739-B2 2′-ethynyl nucleoside derivatives for treatment of viral infections NOVARTIS AG (CH) 2017-11-14 — — US disclosed
US-20170112868-A1 2'-Ethynyl Nucleoside Derivatives for Treatment of Viral Infections NOVARTIS AG (CH) 2017-04-27 — — US disclosed
US-9556216-B2 2′-Ethynyl nucleoside derivatives for treatment of viral infections NOVARTIS AG (CH) 2017-01-31 — — US disclosed
US-20160289259-A1 2'-Branched Nucleosides for Treatment of Viral Infections NOVARTIS AG (CH) 2016-10-06 — — US disclosed
US-20150232501-A1 2'-Ethynyl Nucleoside Derivatives for Treatment of Viral Infections NOVARTIS AG (CH) 2015-08-20 — — US disclosed
US-8980865-B2 Substituted nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2015-03-17 — — US disclosed
US-20140065101-A1 2'-Branched Nucleosides for Treatment of Viral Infections NOVARTIS AG (CH) 2014-03-06 — — US disclosed
US-20130164261-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2013-06-27 — — 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 (5 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-20160289259-A1 2'-Branched Nucleosides for Treatment of Viral Infections EIF2AK2, WNK1, OXSR1 LGALS9 2264/4885LGALS1 2855/4885LGALS3 3510/4885
US-20130164261-A1 SUBSTITUTED NUCLEOTIDE ANALOGS PNP, NUDT1, TYMP LGALS9 4580/4885LGALS1 4793/4885LGALS3 4799/4885
US-20140065101-A1 2'-Branched Nucleosides for Treatment of Viral Infections EIF2AK2, WNK1, OXSR1 LGALS9 2264/4885LGALS1 2855/4885LGALS3 3510/4885
US-20170112868-A1 2'-Ethynyl Nucleoside Derivatives for Treatment of Viral Infections EIF2AK2, NEK5, ERN2 LGALS9 2390/4885LGALS1 4095/4885LGALS3 3930/4885
US-20150232501-A1 2'-Ethynyl Nucleoside Derivatives for Treatment of Viral Infections EIF2AK2, ERN2, NEK5 LGALS9 2366/4885LGALS1 4041/4885LGALS3 3838/4885

“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.

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