SCHEMBL10142408

SCHEMBL10142408

CCCCOC[C@@H]1C[C@@H](O)C(O)O1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ PDK1 Q15118 1/20 0.40
▸ TSHR P16473 2/20 0.39
▸ GBA2 Q9HCG7 2/20 0.34
▸ GBA1 P04062 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ GJB2 P29033 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34

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
SCHEMBL16661755 0.86 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL13696395 0.86 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL12000749 0.86 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL17776458 0.82 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL12289248 0.82 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL16020957 0.80 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL6936113 0.77 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL14380454 0.77 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL12924473 0.76 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1PDK1TSHR
SCHEMBL2618870 0.76 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TDP1PDK1TSHR

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
WO-2017049060-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2017-03-23 — — WO disclosed
US-20170071964-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2017-03-16 — — US disclosed
US-20160122356-A1 METHODS FOR THE PREPARATION OF RIBOSIDES GILEAD SCIENCES, INC. 2016-05-05 — — US disclosed
US-20150152116-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2015-06-04 — — US disclosed
US-20150111839-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2015-04-23 — — US disclosed
EP-2595980-B1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES INC (US) 2014-09-03 — — EP disclosed
US-20120027752-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2012-02-02 — — US disclosed
WO-2012012776-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2012-01-26 — — 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 (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-20160122356-A1 METHODS FOR THE PREPARATION OF RIBOSIDES PRPS1, PRPF4, PRPF31 SMN1; SMN2 340/4885ALDH1A1 1567/4885TDP1 789/4885
US-20150111839-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS PNP, RPIA, HPRT1 SMN1; SMN2 746/4885ALDH1A1 1927/4885TDP1 298/4885
US-20120027752-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS PNP, RPIA, HPRT1 SMN1; SMN2 746/4885ALDH1A1 1927/4885TDP1 298/4885
US-20150152116-A1 METHODS AND COMPOUNDS FOR TREATING PARAMYXOVIRIDAE VIRUS INFECTIONS PNP, RPIA, HPRT1 SMN1; SMN2 746/4885ALDH1A1 1927/4885TDP1 298/4885
US-20170071964-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS ACE, PNP, ACE2 SMN1; SMN2 1867/4885ALDH1A1 1311/4885TDP1 553/4885

“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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