SCHEMBL14769872

SCHEMBL14769872

CC[C@H]1OC(=O)[C@](C)(F)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.40
▸ MAPT P10636 3/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ LMNA P02545 1/20 0.37
▸ BCHE P06276 3/20 0.37
▸ HTT P42858 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TSHR P16473 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ ABCB1 P08183 3/20 0.35
▸ LGALS9 O00182 1/20 0.35
▸ LGALS1 P09382 1/20 0.35
▸ LGALS3 P17931 1/20 0.35
▸ LGALS7; LGALS7B P47929 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 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
SCHEMBL10081975 0.90 LGALS9 (0.43) KMT2AMAPTNPSR1GAABCHE
SCHEMBL475965 0.90 LGALS9 (0.43) KMT2AMAPTNPSR1GAABCHE
SCHEMBL19326490 0.90 LGALS9 (0.43) KMT2AMAPTNPSR1GAABCHE
SCHEMBL12355571 0.88 KMT2A (0.39) KMT2AMAPTNPSR1GAALMNA
SCHEMBL10017434 0.88 KMT2A (0.39) KMT2AMAPTNPSR1GAALMNA
SCHEMBL14473769 0.88 ALDH1A1 (0.47) KMT2AMAPTNPSR1GAALMNA
SCHEMBL12481647 0.88 ALDH1A1 (0.47) KMT2AMAPTNPSR1GAALMNA
SCHEMBL475953 0.88 ALDH1A1 (0.47) KMT2AMAPTNPSR1GAALMNA
SCHEMBL13151599 0.88 ALDH1A1 (0.47) KMT2AMAPTNPSR1GAALMNA
SCHEMBL15117573 0.88 ALDH1A1 (0.47) KMT2AMAPTNPSR1GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403863-B2 Substituted carbonyloxymethylphosphoramidate compounds and pharmaceutical compositions for the treatment of viral infections IDENIX PHARMACEUTICALS LLC (US) 2016-08-02 — — US disclosed
US-9376410-B2 (2R)-2-deoxy-2,2-disubstituted-ribono-1,4-lactone and preparation method and use thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2016-06-28 — — US disclosed
US-20150284351-A1 (2R)-2-DEOXY-2,2-DISUBSTITUTED-RIBONO-1,4-LACTONE AND PREPARATION METHOD AND USE THEREOF TOPHARMAN SHANDONG CO., LTD. (CN) 2015-10-08 — — US disclosed
US-20130064794-A1 Substituted Carbonyloxymethylphosphoramidate Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections IDENIX PHARMACEUTICALS, INC. (US) 2013-03-14 — — 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 (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-20150284351-A1 (2R)-2-DEOXY-2,2-DISUBSTITUTED-RIBONO-1,4-LACTONE AND PREPARATION METHOD AND USE THEREOF RNASEL, RNASE1, RRM1 KMT2A 2076/4885MAPT 4793/4885NPSR1 2514/4885
US-20130064794-A1 Substituted Carbonyloxymethylphosphoramidate Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections PYGL, HAVCR2, PNP KMT2A 2653/4885MAPT 2409/4885NPSR1 4280/4885

“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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