SCHEMBL21643348

SCHEMBL21643348

COc1cc(OC)c(OC)cc1CC[C@@H](O)c1cccc(OCC(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
NSD2 O96028 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
FKBP1A P62942 5/20 0.42
FFAR1 O14842 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL21643352 1.00 LMNA (0.52) LMNAMEN1KMT2AL3MBTL1NSD2
SCHEMBL21643504 0.92 LMNA (0.46) LMNAMEN1KMT2AL3MBTL1PTGDR2
SCHEMBL21643507 0.92 LMNA (0.46) LMNAMEN1KMT2AL3MBTL1PTGDR2
SCHEMBL21643405 0.91 LMNA (0.48) LMNAMEN1KMT2AL3MBTL1PTGDR2
SCHEMBL21643404 0.91 LMNA (0.48) LMNAMEN1KMT2AL3MBTL1PTGDR2
SCHEMBL21643555 0.87 LMNA (0.48) LMNAL3MBTL1PTGDR2FKBP1AFFAR1
SCHEMBL21643552 0.87 LMNA (0.48) LMNAL3MBTL1PTGDR2FKBP1AFFAR1
SCHEMBL2767965 0.86 FKBP1A (0.55) FKBP1A
SCHEMBL21643553 0.86 FKBP1A (0.55) FKBP1A
SCHEMBL21643232 0.86 LMNA (0.50) LMNAL3MBTL1PTGDR2FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239810-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2024-07-18 US disclosed
US-11945827-B2 Rapafucin derivative compounds and methods of use thereof THE JOHNS HOPKINS UNIVERSITY (US) 2024-04-02 US disclosed
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2023-01-05 US disclosed
US-11066416-B2 Rapafucin derivative compounds and methods of use thereof THE JOHNS HOPKINS UNIVERSITY (US) 2021-07-20 US disclosed
WO-2021067439-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2021-04-08 WO disclosed
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2021-04-01 US disclosed
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RAPAFUSYN PHARMACEUTICALS, INC. 2020-02-06 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 (6 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-11066416-B2 Rapafucin derivative compounds and methods of use thereof RICTOR, FKBP14, MTOR LMNA 4788/4885MEN1 3914/4885KMT2A 4739/4885
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR LMNA 4788/4885MEN1 3914/4885KMT2A 4739/4885
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR LMNA 4788/4885MEN1 3914/4885KMT2A 4739/4885
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR LMNA 4788/4885MEN1 3914/4885KMT2A 4739/4885
US-11945827-B2 Rapafucin derivative compounds and methods of use thereof RICTOR, FKBP14, MTOR LMNA 4788/4885MEN1 3914/4885KMT2A 4739/4885
US-20240239810-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, MTOR, FKBP14 LMNA 4818/4885MEN1 3911/4885KMT2A 4771/4885

“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.