SCHEMBL6851292

SCHEMBL6851292

NC1(C(=O)O)C(O)=CC=C(c2ccccc2)C1O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.33
GRM3 Q14832 2/20 0.33
LMNA P02545 1/20 0.33
GRM6 O15303 1/20 0.32
TP53 P04637 1/20 0.32
SRR Q9GZT4 1/20 0.30
PSAT1 Q9Y617 1/20 0.30
THRB P10828 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL11530324 0.67 POLB (0.41) LMNATHRBTDP1
SCHEMBL6849579 0.62 KDM4E (0.36) GRM2GRM3LMNAGRM6SRR
SCHEMBL28121326 0.61 ALDH1A1 (0.41) LMNATDP1
SCHEMBL14991617 0.61 HNF4A (0.34) GRM2GRM3LMNATHRBTDP1
SCHEMBL17480245 0.59 ALDH1A1 (0.42) LMNATDP1
SCHEMBL6570406 0.58 CYP1A2 (0.41) LMNATP53TDP1
Biphenyl SCHEMBL1326612 0.56 ALDH1A1 (0.60) LMNA
Biphenyl SCHEMBL473288 0.56 ALDH1A1 (0.60) LMNATDP1
Biphenyl SCHEMBL4593266 0.56 ALDH1A1 (0.60) LMNATDP1
Biphenyl SCHEMBL335359 0.56 ALDH1A1 (0.60) LMNATDP1

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-1294378-A4 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORP (US) 2004-01-28 EP disclosed
EP-1294378-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-26 EP disclosed
WO-2001089457-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-29 WO disclosed