SCHEMBL14871872

SCHEMBL14871872

COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)COC(=O)CCC(=O)OCC(=O)[C@@]1(O)Cc2c(O)c4c(c(O)c2[C@H](O[C@@H]2C[C@H](C)[C@@H](O)C(C)O2)C1)C(=O)c1c(OC)cccc1C4=O)C[C@@H]3O[C@H]1C[C@@H](C)[C@H](O)C(C)O1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.73
▸ THRB P10828 8/20 0.73
▸ KMT2A Q03164 8/20 0.73
▸ HTT P42858 3/20 0.73
▸ LMNA P02545 2/20 0.73
▸ ABCC4 O15439 2/20 0.73
▸ ABCC2 Q92887 2/20 0.73
▸ ABCC3 O15438 1/20 0.73
▸ ABCB11 O95342 1/20 0.73
▸ RECQL P46063 6/20 0.73
▸ BLM P54132 6/20 0.73
▸ BRCA1 P38398 6/20 0.73
▸ TDP1 Q9NUW8 5/20 0.73
▸ HIF1A Q16665 5/20 0.73
▸ SMN1; SMN2 Q16637 5/20 0.73
▸ TOP2A P11388 4/20 0.73
▸ MAPT P10636 4/20 0.73
▸ MAPK1 P28482 4/20 0.73
▸ CHRM1 P11229 3/20 0.73
▸ TBXA2R P21731 3/20 0.73

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
SCHEMBL15685031 0.95 MEN1 (0.72) MEN1THRBKMT2AHTTLMNA
SCHEMBL14547882 0.95 MEN1 (0.73) MEN1THRBKMT2AHTTLMNA
SCHEMBL14867452 0.93 MEN1 (0.84) MEN1THRBKMT2AHTTLMNA
SCHEMBL26387964 0.91 MEN1 (0.80) MEN1THRBKMT2AHTTLMNA
SCHEMBL16015696 0.91 MEN1 (0.80) MEN1THRBKMT2AHTTLMNA
SCHEMBL19732415 0.91 MEN1 (0.87) MEN1THRBKMT2AHTTLMNA
SCHEMBL14497179 0.91 MEN1 (0.87) MEN1THRBKMT2AHTTLMNA
SCHEMBL13417668 0.91 MEN1 (0.87) MEN1THRBKMT2AHTTLMNA
SCHEMBL10182791 0.91 MEN1 (0.87) MEN1THRBKMT2AHTTLMNA
SCHEMBL18751202 0.91 MEN1 (0.87) MEN1THRBKMT2AHTTLMNA

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-20130096097-A1 PHARMACEUTICAL MULTIMERIC PARTICLES, AND MANUFACTURING METHOD FOR SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2013-04-18 — — 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-20130096097-A1 PHARMACEUTICAL MULTIMERIC PARTICLES, AND MANUFACTURING METHOD FOR SAME SAMM50, MRPS27, COG7 MEN1 1695/4885THRB 4855/4885KMT2A 4125/4885

“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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