SCHEMBL8551272

SCHEMBL8551272

C=CC(=O)OCCn1cc(F)c(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.47
CYP1A2 P05177 1/20 0.47
GRIA1 P42261 1/20 0.47
GRIA2 P42262 1/20 0.47
GRIA3 P42263 1/20 0.47
GRIA4 P48058 1/20 0.47
GRIK5 Q16478 1/20 0.47
KMT2A Q03164 2/20 0.45
CA12 O43570 6/20 0.39
CA9 Q16790 6/20 0.39
CA1 P00915 5/20 0.39
CA2 P00918 5/20 0.39
TSHR P16473 5/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 2/20 0.38
HIF1A Q16665 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL26035300 0.90 LMNA (0.50) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL10508539 0.89 LMNA (0.53) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL24322118 0.83 TYMP (0.54) LMNATYMPHPGD
SCHEMBL28652297 0.79 LMNA (0.67) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL26035304 0.79 TSHR (0.44) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL24205068 0.77 TSHR (0.45) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL28820753 0.77 LMNA (0.71) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11228302 0.75 L3MBTL1 (0.50) LMNATSHRALDH1A1TP53HIF1A
SCHEMBL18561654 0.75 LMNA (0.50) LMNAKDM4ECYP1A2GRIA1GRIA2
SCHEMBL11252365 0.74 LMNA (0.56) LMNAKDM4ECYP1A2GRIA1GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0898590-A1 BIODEGRADABLE POLYMERS GRAFTED WITH AMINO ACIDS CORNELL RESEARCH FOUNDATION, INC. (US) 1999-03-03 EP disclosed
WO-1997042249-A1 BIODEGRADABLE POLYMERS GRAFTED WITH AMINO ACIDS CORNELL RESEARCH FOUNDATION, INC. (US) 1997-11-13 WO disclosed
US-5610241-A Reactive graft polymer with biodegradable polymer backbone and method for preparing reactive biodegradable polymers CORNELL RESEARCH FOUNDATION, INC. (US) 1997-03-11 US disclosed