SCHEMBL14616525

SCHEMBL14616525

CC[C@H]1O[C@H](OC(=O)c2ccccc2)C(=O)C1C

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
SCHEMBL15394247 1.00 LGALS9 (0.40) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL15071556 1.00 LGALS9 (0.40) LGALS9LGALS1LGALS3LGALS7; LGALS7BLMNA
SCHEMBL15071561 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637475-B1 Modified 2′ and 3′ nucleoside prodrugs for treating flaviviridae infections IDENIX PHARMACEUTICALS, INC. (US) 2014-01-28 — — US disclosed
US-20130330297-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS IDENIX PHARMACEUTICALS, INC. (US) 2013-12-12 — — US disclosed
US-20130149283-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS UNIVERSITA DEGLI STUDI DI CAGLIARI (IT) 2013-06-13 — — US disclosed
US-20130017171-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS UNIVERSITA DEGLI STUDI DI CAGLIARI (IT) 2013-01-17 — — 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-20130149283-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS HAVCR2, HCCS, PYGL LGALS9 1017/4885LGALS1 648/4885LGALS3 292/4885
US-20130330297-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS PNP, UGT1A3, UGT2B7 LGALS9 1795/4885LGALS1 1191/4885LGALS3 820/4885
US-20130017171-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS HAVCR2, HCCS, PYGL LGALS9 1017/4885LGALS1 648/4885LGALS3 292/4885

“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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