SCHEMBL8510290

SCHEMBL8510290

CC(C)(C)OC(=O)CN1CCN(CC(=O)OC(C)(C)C)CCN(Cc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.50
LMNA P02545 3/20 0.47
GAA P10253 2/20 0.47
THRB P10828 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP2C19 P33261 1/20 0.45
HDAC4 P56524 1/20 0.45
KCNH2 Q12809 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.44
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL25843065 0.94 LTA4H (0.46) LTA4HLMNAGAATHRBSMN1; SMN2
SCHEMBL10063608 0.87 ALDH1A1 (0.57) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL8513493 0.87 SIGMAR1 (0.47) MEN1KMT2AHDAC4KCNH2HDAC1
SCHEMBL9610817 0.86 ITGB3 (0.46) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL17920218 0.86 CHKA (0.44) LMNAGAASMN1; SMN2ALDH1A1MEN1
SCHEMBL9610831 0.85 LMNA (0.53) LMNASMN1; SMN2ALDH1A1HDAC6DRD4
SCHEMBL12732683 0.85 LMNA (0.53) LMNASMN1; SMN2ALDH1A1HDAC6DRD4
SCHEMBL2514655 0.84 VEGFA (0.54) LTA4HLMNAGAATHRBSMN1; SMN2
SCHEMBL30443787 0.83 ALDH1A1 (0.43) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL16353103 0.82 ALDH1A1 (0.46) LMNASMN1; SMN2ALDH1A1MEN1KMT2A

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651411-B1 METHODS AND COMPOSITIONS FOR IMPROVED F-18 LABELING OF PROTEINS, PEPTIDES AND OTHER MOLECULES IMMUNOMEDICS INC (US) 2020-09-16 EP disclosed
EP-3242691-A1 RADIOSENSITIVITY OF FLUOROPHORES AND USE OF RADIOPROTECTIVE AGENTS FOR DUAL-MODALITY IMAGING Immunomedics, Inc. (US) 2017-11-15 EP disclosed
US-20170283442-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. 2017-10-05 US disclosed
US-20170283442-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. 2017-10-05 US disclosed
US-20170283442-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. 2017-10-05 US disclosed
EP-3218015-A2 METHODS AND COMPOSITIONS FOR IMPROVED LABELING OF TARGETING PEPTIDES Immunomedics, Inc. (US) 2017-09-20 EP disclosed
US-20170007727-A1 METHODS OF IMAGING WITH Ga-68 LABELED MOLECULES IMMUNOMEDICS, INC. 2017-01-12 US disclosed
WO-2017007807-A1 IMPROVED METHODS OF IMAGING WITH Ga-68 LABELED MOLECULES IMMUNOMEDICS, INC. (US) 2017-01-12 WO disclosed
US-20170007727-A1 METHODS OF IMAGING WITH Ga-68 LABELED MOLECULES IMMUNOMEDICS, INC. 2017-01-12 US disclosed
US-20170007727-A1 METHODS OF IMAGING WITH Ga-68 LABELED MOLECULES IMMUNOMEDICS, INC. 2017-01-12 US disclosed
US-20140017168-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2014-01-16 US disclosed
US-20140017168-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2014-01-16 US disclosed
US-20140017168-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2014-01-16 US disclosed
US-8545809-B2 Methods and compositions for improved 18F labeling of proteins, peptides and other molecules IMMUNOMEDICS, INC. (US) 2013-10-01 US disclosed
US-8545809-B2 Methods and compositions for improved 18F labeling of proteins, peptides and other molecules IMMUNOMEDICS, INC. (US) 2013-10-01 US disclosed
US-8545809-B2 Methods and compositions for improved 18F labeling of proteins, peptides and other molecules IMMUNOMEDICS, INC. (US) 2013-10-01 US disclosed
WO-2012082618-A2 METHODS AND COMPOSITIONS FOR IMPROVED F-18 LABELING OF PROTEINS, PEPTIDES AND OTHER MOLECULES IMMUNOMEDICS, INC. (US) 2012-06-21 WO disclosed
US-20120134920-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2012-05-31 US disclosed
US-20120134920-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2012-05-31 US disclosed
US-20120134920-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2012-05-31 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 (4 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-20120134920-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules F13B, FCGRT, PAICS LTA4H 4557/4885LMNA 3399/4885GAA 654/4885
US-20170007727-A1 METHODS OF IMAGING WITH Ga-68 LABELED MOLECULES BSG, HBG1, HBG2 LTA4H 2150/4885LMNA 2294/4885GAA 32/4885
US-20140017168-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules F13B, FCGRT, PAICS LTA4H 4557/4885LMNA 3399/4885GAA 654/4885
US-20170283442-A1 Methods and Compositions for Improved F-18 Labeling of Proteins, Peptides and Other Molecules F13B, PAICS, MRPL19 LTA4H 4614/4885LMNA 3436/4885GAA 620/4885

“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.