SCHEMBL10036615

SCHEMBL10036615

CC(C)COCCCSCCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PLA2G4B P0C869 6/20 0.47
BHMT Q93088 4/20 0.40
TSHR P16473 3/20 0.40
PLA2G2C Q5R387 1/20 0.36
PTGS1 P23219 1/20 0.34
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL20127148 0.81 ALDH1A1 (0.39) KMT2ATSHRALDH1A1
SCHEMBL16411033 0.80 PLA2G4B (0.54) LMNAKMT2AHSD17B10TDP1PLA2G4B
SCHEMBL14473679 0.80 LMNA (0.45) LMNAKMT2AHSD17B10TDP1PLA2G4B
SCHEMBL12590394 0.80 PLA2G4B (0.42) LMNAKMT2AHSD17B10TDP1PLA2G4B
SCHEMBL10879931 0.80 ALDH1A1 (0.52) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL17909259 0.78 TSHR (0.46) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL10599228 0.78 ALDH1A1 (0.55) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL10596601 0.78 ALDH1A1 (0.55) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL17909058 0.78 TSHR (0.46) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL17908953 0.78 TSHR (0.46) LMNAKMT2AHSD17B10TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180030207-A1 LINEAR CYCLODEXTRIN COPOLYMERS CALIFORNIA INSTITUTE OF TECHNOLOGY 2018-02-01 US disclosed
US-20170049903-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALIFORNIA INSTITUTE OF TECHNOLOGY 2017-02-23 US disclosed
US-20150050233-A1 COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALANDO PHARMACEUTICALS, INC. (US) 2015-02-19 US disclosed
US-20150031753-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALANDO PHARMACEUTICALS, INC. (US) 2015-01-29 US disclosed
US-20150025126-A1 METHOD OF PREPARING A SUPRAMOLECULAR COMPLEX CONTAINING A THERAPEUTIC AGENT AND A MULTI-DIMENSIONAL POLYMER NETWORK CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2015-01-22 US disclosed
US-20130197210-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALANDO PHARMACEUTICALS, INC. (US) 2013-08-01 US disclosed
US-8277846-B2 Complexing agents for compositions containing inclusion complexes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-10-02 US disclosed
US-20120172525-A1 COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALANDO PHARMACEUTICALS, INC. (US) 2012-07-05 US disclosed
US-8092833-B2 Compositions containing inclusion complexes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-01-10 US disclosed
US-20110256104-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALANDO PHARMACEUTICALS, INC. (US) 2011-10-20 US disclosed
US-20110182864-A1 COMPOSITIONS CONTAINING INCLUSION COMPLEXES CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2011-07-28 US disclosed
US-7968123-B2 Complexing agents for compositions containing inclusion complexes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2011-06-28 US disclosed
US-20110144190-A1 METHOD OF PREPARING A SUPRAMOLECULAR COMPLEX CONTAINING A THERAPEUTIC AGENT AND A MULTI-DIMENSIONAL POLYMER NETWORK CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2011-06-16 US disclosed
US-7807198-B2 Compositions containing inclusion complexes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2010-10-05 US disclosed
US-20080279954-A1 Method of preparing a supramolecular complex containing a therapeutic agent and a multi-dimensional polymer network CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2008-11-13 US disclosed
US-7375096-B1 Method of preparing a supramolecular complex containing a therapeutic agent and a multi-dimensional polymer network CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2008-05-20 US disclosed
US-20070128167-A1 Complexing agents for compositions containing inclusion complexes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2007-06-07 US disclosed
US-20070025952-A1 Linear cyclodextrin copolymers CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2007-02-01 US disclosed
US-7166302-B2 Complexing agents for compositions containing inclusion complexes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2007-01-23 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 (11 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-20150025126-A1 METHOD OF PREPARING A SUPRAMOLECULAR COMPLEX CONTAINING A THERAPEUTIC AGENT AND A MULTI-DIMENSIONAL POLYMER NETWORK PICALM, IMMT, PAICS LMNA 1531/4885KMT2A 4456/4885HSD17B10 2297/4885
US-20110256104-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES INTS6, EXOSC5, PCBP1 LMNA 1557/4885KMT2A 4801/4885HSD17B10 2411/4885
US-20180030207-A1 LINEAR CYCLODEXTRIN COPOLYMERS DDOST, SI, PDIA6 LMNA 3425/4885KMT2A 4873/4885HSD17B10 195/4885
US-20150031753-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES INTS6, EXOSC5, PCBP1 LMNA 1557/4885KMT2A 4801/4885HSD17B10 2411/4885
US-20070025952-A1 Linear cyclodextrin copolymers DDOST, SI, PDIA6 LMNA 3425/4885KMT2A 4873/4885HSD17B10 195/4885
US-20080279954-A1 Method of preparing a supramolecular complex containing a therapeutic agent and a multi-dimensional polymer network PICALM, IMMT, PAICS LMNA 1531/4885KMT2A 4456/4885HSD17B10 2297/4885
US-20110182864-A1 COMPOSITIONS CONTAINING INCLUSION COMPLEXES EXOSC5, EXOSC9, INTS6 LMNA 1441/4885KMT2A 4806/4885HSD17B10 2149/4885
US-20070128167-A1 Complexing agents for compositions containing inclusion complexes INTS6, EXOSC5, PCBP1 LMNA 1557/4885KMT2A 4801/4885HSD17B10 2411/4885
US-20150050233-A1 COMPOSITIONS CONTAINING INCLUSION COMPLEXES EXOSC5, EXOSC9, INTS6 LMNA 1441/4885KMT2A 4806/4885HSD17B10 2149/4885
US-20170049903-A1 COMPLEXING AGENTS FOR COMPOSITIONS CONTAINING INCLUSION COMPLEXES INTS6, EXOSC5, PCBP1 LMNA 1557/4885KMT2A 4801/4885HSD17B10 2411/4885
US-20110144190-A1 METHOD OF PREPARING A SUPRAMOLECULAR COMPLEX CONTAINING A THERAPEUTIC AGENT AND A MULTI-DIMENSIONAL POLYMER NETWORK PICALM, IMMT, PAICS LMNA 1531/4885KMT2A 4456/4885HSD17B10 2297/4885

“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.