SCHEMBL1271016

SCHEMBL1271016

O=C(O)CCCOc1ccc(O)cc1Oc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.57
FFAR4 Q5NUL3 5/20 0.54
FFAR1 O14842 5/20 0.51
TSHR P16473 1/20 0.46
LMNA P02545 1/20 0.44
RAB9A P51151 1/20 0.44
CYSLTR2 Q9NS75 2/20 0.43
CYSLTR1 Q9Y271 2/20 0.43
TTR P02766 1/20 0.43
LTA4H P09960 1/20 0.43
ESR1 P03372 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
SCHEMBL1271015 0.85 FFAR4 (0.60) CAMK2AFFAR4FFAR1TSHRLMNA
SCHEMBL1270507 0.84 CAMK2A (0.61) CAMK2AFFAR1TTR
SCHEMBL2349799 0.81 CAMK2A (0.71) CAMK2AFFAR4FFAR1
SCHEMBL1271029 0.78 LMNA (0.59) CAMK2AFFAR4FFAR1LMNALTA4H
SCHEMBL21633625 0.78 CAMK2A (0.59) CAMK2ATSHRTTRLTA4H
SCHEMBL2093682 0.77 C5AR1 (0.56) CAMK2ALMNARAB9ATTRLTA4H
SCHEMBL9762157 0.77 LMNA (0.67) CAMK2AFFAR4FFAR1LMNALTA4H
SCHEMBL3424980 0.77 CAMK2A (0.73) CAMK2AFFAR4FFAR1
SCHEMBL3947131 0.75 CNR2 (0.58) FFAR4FFAR1CYSLTR2CYSLTR1ESR1
SCHEMBL11587499 0.75 FFAR4 (0.75) FFAR4FFAR1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9080015-B2 Biocompatible polymers for medical devices RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-07-14 US disclosed
US-20120178885-A1 BIOCOMPATIBLE POLYMERS FOR MEDICAL DEVICES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2012-07-12 US disclosed
EP-2459637-A1 BIOCOMPATIBLE POLYMERS FOR MEDICAL DEVICES Rutgers, The State University of New Jersey (US) 2012-06-06 EP disclosed
WO-2011014859-A1 BIOCOMPATIBLE POLYMERS FOR MEDICAL DEVICES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-02-03 WO disclosed