SCHEMBL8873233

SCHEMBL8873233

Oc1nc2c(F)cc(F)cc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.44
F10 P00742 1/20 0.42
TPSAB1 Q15661 1/20 0.35
TPSD1 Q9BZJ3 1/20 0.35
TPSG1 Q9NRR2 1/20 0.35
DHODH Q02127 2/20 0.35
PTGDR2 Q9Y5Y4 3/20 0.34
DAO P14920 2/20 0.33
SSTR5 P35346 2/20 0.33
DDO Q99489 1/20 0.33
TNKS O95271 1/20 0.33
PARP1 P09874 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
PARP3 Q9Y6F1 1/20 0.33
ALPL P05186 1/20 0.33
ALPI P09923 1/20 0.33
ALPG P10696 1/20 0.33
IDO1 P14902 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL1170829 0.79 EGLN1 (0.43) EGLN1F10DHODHPTGDR2SSTR5
SCHEMBL17276072 0.76 PNP (0.47) EGLN1F10TPSAB1TPSD1TPSG1
SCHEMBL20919865 0.76 EGLN1 (0.41) EGLN1F10TPSAB1TPSD1TPSG1
SCHEMBL2105970 0.76 EGLN1 (0.41) EGLN1F10TPSAB1TPSD1TPSG1
SCHEMBL8265513 0.76 HTT (0.47) EGLN1F10DHODHPTGDR2SSTR5
SCHEMBL13542745 0.72 HSD17B10 (0.41) EGLN1F10TPSAB1TPSD1TPSG1
SCHEMBL29439058 0.72 F10 (0.48) EGLN1F10PTGDR2SSTR5IDO1
SCHEMBL4269246 0.72 F10 (0.39) EGLN1F10TPSAB1TPSD1TPSG1
SCHEMBL4269239 0.72 F10 (0.51) EGLN1F10SSTR5IDO1SLC40A1
SCHEMBL15844337 0.71 IDO1 (0.59) EGLN1F10SSTR5IDO1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5597922-A Glycine receptor antagonist pharmacophore STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON (US) 1997-01-28 US disclosed