SCHEMBL21132597

SCHEMBL21132597

CC(C)O[C@H]1OC(CO)[C@@H](O)C(O)C1O[C@H]1OC(CO)[C@@H](O)C(O)C1O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ LGALS8 O00214 1/20 0.49
▸ LGALS3 P17931 1/20 0.49
▸ LGALS4 P56470 1/20 0.49
▸ TYR P14679 4/20 0.48
▸ IGF2R P11717 2/20 0.47
▸ PTPN1 P18031 1/20 0.46
▸ GJA1 P17302 1/20 0.45
▸ GJB2 P29033 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CD209 Q9NNX6 1/20 0.44

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
SCHEMBL12563491 0.92 TYR (0.56) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL12902015 0.92 TYR (0.56) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL12604931 0.92 TYR (0.56) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL12563490 0.92 TYR (0.56) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL12901988 0.92 TYR (0.56) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL16207269 0.91 CD209 (0.43) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL25142277 0.89 CD209 (0.55) MEN1KMT2ALGALS8LGALS3LGALS4
SCHEMBL22224176 0.87 ALDH1A1 (0.43) TYRALDH1A1L3MBTL1
SCHEMBL20713712 0.87 L3MBTL1 (0.51) TYRPTPN1ALDH1A1L3MBTL1
SCHEMBL20713676 0.87 L3MBTL1 (0.51) TYRPTPN1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10443026-B2 Polygonal scaffold and manufacturing method thereof, and protein modulator and manufacturing method thereof NATIONAL TSING HUA UNIVERSITY (TW) 2019-10-15 — — US disclosed
US-20190194590-A1 POLYGONAL SCAFFOLD AND MANUFACTURING METHOD THEREOF, AND PROTEIN MODULATOR AND MANUFACTURING METHOD THEREOF NATIONAL TSING HUA UNIVERSITY (TW) 2019-06-27 — — 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 (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-20190194590-A1 POLYGONAL SCAFFOLD AND MANUFACTURING METHOD THEREOF, AND PROTEIN MODULATOR AND MANUFACTURING METHOD THEREOF PPIA, PPIH, FKBP1A MEN1 2696/4885KMT2A 3944/4885LGALS8 3873/4885
US-10443026-B2 Polygonal scaffold and manufacturing method thereof, and protein modulator and manufacturing method thereof PPIA, PPIH, FKBP1A MEN1 2677/4885KMT2A 3765/4885LGALS8 4198/4885

“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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