SCHEMBL1686987

SCHEMBL1686987

O=C1CCCCC(C(C(=O)O)c2ccccc2)O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 3/20 0.46
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA1 P00915 1/20 0.43
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
HTR1E P28566 1/20 0.41
KMT2A Q03164 1/20 0.41
S1PR3 Q99500 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
CHRM3 P20309 1/20 0.39
MCL1 Q07820 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL9620234 0.79 ALDH1A1 (0.43) SLC6A3ALDH1A1KDM4EHPGDRAB9A
SCHEMBL4923062 0.77 MEN1 (0.43) SLC6A3ALDH1A1KDM4EHPGDNPC1
SCHEMBL15846301 0.76 SLC6A3 (0.70) SLC6A3KDM4EHPGDMAPTLMNA
SCHEMBL15210146 0.74 IDUA (0.36) KDM4EL3MBTL1CA1LMNAMCL1
SCHEMBL15151 0.74 IDUA (0.36) KDM4EL3MBTL1CA1LMNAMCL1
SCHEMBL69127 0.72 HTR1E (0.65) SLC6A3TP53MAPTLMNAMEN1
SCHEMBL28622389 0.72 HTR1E (0.65) SLC6A3TP53MAPTLMNAMEN1
SCHEMBL12531975 0.71 HTR1E (0.63) SLC6A3TP53MAPTLMNAMEN1
SCHEMBL67219 0.71 HTR1E (0.63) SLC6A3TP53MAPTLMNAMEN1
SCHEMBL8373014 0.70 EPHX1 (0.40) KDM4EL3MBTL1CA1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011047486-A1 BIODEGRADABLE THERMORESPONSIVE HYDROGELS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2011-04-28 WO claimed
EP-2730604-B1 FUNCTIONALIZED CAPROLACTONE MONOMERS USEFUL FOR MAKING POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS UNIV ALBERTA (CA) 2018-10-24 EP disclosed
US-9139553-B2 Poly(ethylene oxide)-block-poly(ester) block copolymers THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2015-09-22 US disclosed
EP-1994081-B1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS UNIV ALBERTA (CA) 2014-05-21 EP disclosed
EP-2730604-A2 Functionalized caprolactone monomers useful for making poly(ethylene oxide)-block-poly(ester) block copolymers The Governors of the University of Alberta (CA) 2014-05-14 EP disclosed
US-20130116428-A1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2013-05-09 US disclosed
US-8309515-B2 Poly(ethylene oxide)-block-poly(ester) block copolymers THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2012-11-13 US disclosed
WO-2011047486-A1 BIODEGRADABLE THERMORESPONSIVE HYDROGELS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2011-04-28 WO disclosed
US-20100137206-A1 NOVEL LIGAND GUIDED BLOCK COPOLYMERS FOR TARGETED DRUG DELIVERY THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2010-06-03 US disclosed
US-20100069295-A1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2010-03-18 US disclosed
EP-1994081-A1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS The Governors of the University of Alberta (CA) 2008-11-26 EP disclosed
WO-2008071009-A1 NOVEL LIGAND GUIDED BLOCK COPOLYMERS FOR TARGETED DRUG DELIVERY THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2008-06-19 WO disclosed
WO-2007106997-A1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2007-09-27 WO 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 (3 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-20100069295-A1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS EBPL, ELOB, DCLRE1B SLC6A3 4842/4885ALDH1A1 4765/4885KDM4E 2938/4885
US-20130116428-A1 NOVEL POLY(ETHYLENE OXIDE)-BLOCK-POLY(ESTER) BLOCK COPOLYMERS EBPL, ELOB, DCLRE1B SLC6A3 4842/4885ALDH1A1 4765/4885KDM4E 2938/4885
US-20100137206-A1 NOVEL LIGAND GUIDED BLOCK COPOLYMERS FOR TARGETED DRUG DELIVERY EBPL, EDNRB, BMPR1B SLC6A3 4814/4885ALDH1A1 4782/4885KDM4E 4042/4885

“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.