SCHEMBL21258841

SCHEMBL21258841

CCC(C)(OC1C(O)[C@H](C(C)(C)OC2C(O)[C@H](OCCN)OC(CO)[C@H]2O)OC(CO)[C@H]1O)[C@@H]1OC(CO)C(=O)C(O)C1O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ IGF2R P11717 4/20 0.35
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ LGALS8 O00214 1/20 0.30
▸ LGALS3 P17931 1/20 0.30
▸ LGALS4 P56470 1/20 0.30

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
SCHEMBL19682225 0.79 IGF2R (0.47) IGF2RALDH1A1LGALS8LGALS3LGALS4
SCHEMBL19682226 0.79 IGF2R (0.47) IGF2RALDH1A1LGALS8LGALS3LGALS4
SCHEMBL24251933 0.75 IGF2R (0.48) IGF2RLGALS8LGALS3LGALS4
SCHEMBL16621011 0.64 IGF2R (0.64) IGF2RALDH1A1LGALS8LGALS3LGALS4
SCHEMBL22360309 0.64 IGF2R (0.64) IGF2RALDH1A1LGALS8LGALS3LGALS4
SCHEMBL24107719 0.64 IGF2R (0.64) IGF2RALDH1A1LGALS8LGALS3LGALS4
SCHEMBL16621008 0.64 IGF2R (0.64) IGF2RALDH1A1LGALS8LGALS3LGALS4
SCHEMBL10961423 0.62 IGF2R (0.59) IGF2RLGALS8LGALS3LGALS4
SCHEMBL10961421 0.62 IGF2R (0.59) IGF2RLGALS8LGALS3LGALS4
SCHEMBL21321251 0.61 IGF2R (0.67) IGF2RALDH1A1LGALS8LGALS3LGALS4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190247495-A1 NOVEL SYNTHETIC ANTICANCER, ANTIFUNGAL, AND ANTIBACTERIAL VACCINES WAYNE STATE UNIVERSITY 2019-08-15 — — 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 (1 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-20190247495-A1 NOVEL SYNTHETIC ANTICANCER, ANTIFUNGAL, AND ANTIBACTERIAL VACCINES ERG28, DDOST, STT3A IGF2R 249/4885KDM4E 4184/4885ALDH1A1 4333/4885

“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.

Send feedback