SCHEMBL8695840

SCHEMBL8695840

COC1CCOC(c2ccccc2OCc2ccc(-n3ccnc3C)cc2F)C1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.36
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MCHR1 Q99705 1/20 0.33
GUCY1B2 O75343 1/20 0.32
GUCY1A2 P33402 1/20 0.32
GUCY1A1 Q02108 1/20 0.32
GUCY1B1 Q02153 1/20 0.32
GPBAR1 Q8TDU6 1/20 0.32
PTGER1 P34995 1/20 0.31
CSF1R P07333 1/20 0.31
MAPK14 Q16539 3/20 0.31
HTR6 P50406 1/20 0.31
NR3C2 P08235 1/20 0.31
RORC P51449 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
Hydrochloric Acid SCHEMBL8694847 0.89 ICMT (0.33) ALOX5MCHR1CSF1R
SCHEMBL8696318 0.87 ALOX5 (0.33) ALOX5HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL8698167 0.83 NR3C2 (0.39) ALOX5HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL8700996 0.83 ALOX5 (0.44) ALOX5HTR1AMCHR1NR3C2
SCHEMBL8694707 0.79 ALOX5 (0.44) ALOX5HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL8701075 0.77 ALOX5 (0.49) ALOX5MCHR1CSF1RNR3C2
Hydrochloric Acid SCHEMBL8700999 0.77 ALOX5 (0.48) ALOX5MCHR1CSF1RNR3C2
Hydrochloric Acid SCHEMBL8697471 0.77 ALOX5 (0.44) ALOX5MCHR1CSF1RNR3C2
SCHEMBL8698238 0.76 ALOX5 (0.44) ALOX5HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL8701027 0.76 ALOX5 (0.46) ALOX5MCHR1GPBAR1CSF1RNR3C2

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
US-5753682-A Imidazole lipoxygenase inhibitors PFIZER INC. (US) 1998-05-19 US claimed
US-5753682-A Imidazole lipoxygenase inhibitors PFIZER INC. (US) 1998-05-19 US disclosed