SCHEMBL16489271

SCHEMBL16489271

CC1C(COC(=O)c2ccccc2)OC(Br)C(OC(=O)c2ccccc2)C1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ USP2 O75604 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LGALS9 O00182 1/20 0.42
▸ LGALS1 P09382 1/20 0.42
▸ LGALS3 P17931 1/20 0.42
▸ LGALS7; LGALS7B P47929 1/20 0.42
▸ PTPN1 P18031 4/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GAPDH P04406 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ PTPN2 P17706 1/20 0.39
▸ PTPN11 Q06124 1/20 0.39

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
SCHEMBL19036047 0.90 PTPN1 (0.42) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL25584339 0.89 POLB (0.52) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL19263956 0.89 POLB (0.52) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL16489270 0.87 LGALS9 (0.43) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL5707687 0.87 USP2 (0.55) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL2493929 0.87 USP2 (0.55) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL11061066 0.87 USP2 (0.55) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL14274463 0.87 USP2 (0.55) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL11726595 0.87 USP2 (0.55) POLBMEN1USP2KMT2AALDH1A1
SCHEMBL26801670 0.87 USP2 (0.55) POLBMEN1USP2KMT2AALDH1A1

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-20150050367-A1 TIMOSAPONIN COMPOUNDS GOLDPORP PHARMA LIMITED (HK) 2015-02-19 — — 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-20150050367-A1 TIMOSAPONIN COMPOUNDS APP, IAPP, BACE1 POLB 3050/4885MEN1 1058/4885USP2 4673/4885

“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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