SCHEMBL4645541

SCHEMBL4645541

C=CC(=O)OC(C)OC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
KMT2A Q03164 2/20 0.42
CA12 O43570 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
TP53 P04637 2/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37

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
SCHEMBL434162 0.89 TSHR (0.49) MAPTPDCD1CD274CA1CA2
SCHEMBL10728252 0.86 CA1 (0.41) PDCD1CD274CA1CA2CA12
SCHEMBL8982618 0.85 SMN1; SMN2 (0.42) MAPTCA1CA2KMT2ACA12
SCHEMBL18544294 0.84 ALDH1A1 (0.42) MAPTPDCD1CD274CA1CA2
SCHEMBL7797255 0.83 KMT2A (0.57) CA1CA2KMT2ATP53TSHR
SCHEMBL8953220 0.82 ALDH1A1 (0.44) MAPTPDCD1CD274CA1CA2
SCHEMBL8982606 0.81 RAB9A (0.42) MAPTPDCD1CD274CA1CA2
SCHEMBL28773775 0.80 MAPT (0.47) MAPTPDCD1CD274CA1CA2
SCHEMBL1152390 0.79 MAPT (0.56) MAPTKMT2ATSHRALDH1A1NPC1
SCHEMBL301791 0.78 ALDH1A1 (0.48) MAPTKMT2ATSHRALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022215213-A1 COMPOSITION FOR FORMING ENZYME SENSOR ELECTRODE, ENZYME SENSOR ELECTRODE, AND ENZYME SENSOR 東洋インキSCホールディングス株式会社 2022-10-13 WO disclosed
US-20090048392-A1 Resin Pulley and Resin Composition JTEKT CORPORATION (JP) 2009-02-19 US disclosed
EP-1967765-A1 RESINOUS PULLEY AND RESIN COMPOSITION JTEKT Corporation (JP) 2008-09-10 EP disclosed
EP-1411374-B1 REFLECTION PREVENTING FILM LAMINATED BODY AND METHOD OF MANUFACTURING THE LAMINATED BODY JSR CORP (JP) 2008-08-13 EP disclosed
US-7261931-B2 Reflection preventing film laminated body and method of manufacturing the laminated body JSR CORPORATION (JP) 2007-08-28 US disclosed
US-20060269660-A1 Reflection preventing film laminated body and method of manufacturing the laminated body JSR CORPORATION (JP) 2006-11-30 US disclosed
US-20040191478-A1 Reflection preventing film laminated body and method of manufacturing the laminated body JSR CORPORATION (JP) 2004-09-30 US disclosed
EP-1411374-A1 REFLECTION PREVENTING FILM LAMINATED BODY AND METHOD OF MANUFACTURING THE LAMINATED BODY JSR Corporation (JP) 2004-04-21 EP disclosed