SCHEMBL7742520

SCHEMBL7742520

CC(=O)OCc1ccc(OCCCCC2COC(C)(C)O2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.38
ITGA2B P08514 4/20 0.38
ALDH1A1 P00352 1/20 0.38
ABCB11 O95342 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP3A4 P08684 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NAAA Q02083 1/20 0.36
ASAH1 Q13510 1/20 0.36
GPR119 Q8TDV5 3/20 0.36
ITGAV P06756 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL7161401 0.81 HTR1A (0.36) ABCB11TMEM97SIGMAR1LMNAMAPT
SCHEMBL6270189 0.80 L3MBTL1 (0.40) MAPTHTR1AADRA1DADRA1AADRA1B
SCHEMBL10759344 0.80 ALDH1A1 (0.40) ALDH1A1TMEM97SIGMAR1LMNAHTR1A
SCHEMBL7165644 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMAPTHTR1AADRA1D
SCHEMBL10757573 0.79 HRH3 (0.43) ALDH1A1TMEM97SIGMAR1LMNAMAPK1
SCHEMBL10762271 0.78 PLA2G4B (0.43) ALDH1A1TMEM97SIGMAR1LMNAHTR1A
SCHEMBL10762275 0.78 PLA2G4B (0.43) ALDH1A1TMEM97SIGMAR1LMNAHTR1A
SCHEMBL10758766 0.76 PPARG (0.38) ITGB3ITGA2BTMEM97SIGMAR1LMNA
SCHEMBL10758750 0.76 MAPK14 (0.41) ALDH1A1TMEM97SIGMAR1HTR1AADRA1D
SCHEMBL12774506 0.76 TMEM97 (0.47) ALDH1A1TMEM97SIGMAR1LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200628-A2 ATTACHMENT OF OLIGONUCLEOTIDES TO SOLID SUPPORTS THROUGH SCHIFF BASE TYPE LINKAGES FOR CAPTURE AND DETECTION OF NUCLEIC ACIDS Epoch Biosciences, Inc. (US) 2002-05-02 EP disclosed
WO-2001009385-A2 ATTACHMENT OF OLIGONUCLEOTIDES TO SOLID SUPPORTS THROUGH SCHIFF BASE TYPE LINKAGES FOR CAPTURE AND DETECTION OF NUCLEIC ACIDS EPOCH BIOSCIENCES, INC. (US) 2001-02-08 WO disclosed