SCHEMBL4358988

SCHEMBL4358988

O=[Mo](=O)=O.c1scc2c1OCCO2

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 1/20 0.38
ICAM1 P05362 1/20 0.38
ITGAL P20701 1/20 0.38
HTT P42858 3/20 0.33
LMNA P02545 2/20 0.33
CRHBP P24387 2/20 0.33
CRHR2 Q13324 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
BAZ2B Q9UIF8 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL33274 0.89
SCHEMBL456419 0.89 ITGB2 (0.45) ITGB2ICAM1ITGALHTTLMNA
Methane SCHEMBL28353935 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
Water SCHEMBL20425715 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
SCHEMBL28535767 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
SCHEMBL23247119 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
Water SCHEMBL29163404 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
SCHEMBL25248367 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
SCHEMBL28570678 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA
SCHEMBL28543841 0.86 ITGB2 (0.43) ITGB2ICAM1ITGALHTTLMNA

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
WO-2009061845-A1 RAPID MICROWAVE-SOLVOTHERMAL SYNTHESIS AND SURFACE MODIFICATION OF NANOSTRUCTURED PHOSPHO-OLIVINE CATHODES FOR LITHIUM ION BATTERIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-05-14 WO disclosed
US-20090117020-A1 RAPID MICROWAVE-SOLVOTHERMAL SYNTHESIS AND SURFACE MODIFICATION OF NANOSTRUCTURED PHOSPHO-OLIVINE CATHODES FOR LITHIUM ION BATTERIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-05-07 US disclosed