SCHEMBL4606403

SCHEMBL4606403

C=C(COC(=O)/C=C\C(=O)OCC(=C)C(=O)O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.41
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ATM Q13315 1/20 0.37
MAPT P10636 5/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TET2 Q6N021 3/20 0.33
TET3 O43151 1/20 0.33
TET1 Q8NFU7 1/20 0.33
MDM4 O15151 1/20 0.33
MDM2 Q00987 1/20 0.33
POLB P06746 1/20 0.33
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32

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
SCHEMBL2850630 0.84 TSHR (0.46) ALOX15HSD17B10LMNAALDH1A1THRB
SCHEMBL7764840 0.80 HCAR2 (0.44) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL8608390 0.80 HCAR2 (0.44) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL29048483 0.78 LMNA (0.59) MAPTLMNAALDH1A1
SCHEMBL29048484 0.78 LMNA (0.59) MAPTLMNAALDH1A1
SCHEMBL7764838 0.74 HCAR2 (0.56) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL27342684 0.74 HCAR2 (0.48) HCAR2ATMMAPTLMNAALDH1A1
SCHEMBL14535450 0.74 HCAR2 (0.48) HCAR2ATMMAPTLMNAALDH1A1
SCHEMBL6249063 0.73 ALOX15 (0.40) ALOX15HSD17B10LMNASMN1; SMN2TET2
SCHEMBL868205 0.73 HCAR2 (0.43) HCAR2ATMMAPTCACNA1BAPBA1

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
EP-0872529-B2 BINDER FOR BUILDING STRUCTURES ASAHI CHEMICAL IND (JP) 2008-07-09 EP disclosed
EP-0872529-B1 BINDER FOR BUILDING STRUCTURES ASAHI CHEMICAL IND (JP) 2004-09-29 EP disclosed
US-6015845-A Binder for building structure ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2000-01-18 US disclosed
EP-0872529-A1 BINDER FOR BUILDING STRUCTURES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1998-10-21 EP disclosed