SCHEMBL6170668

SCHEMBL6170668

CCCCCCOc1ccccc1CC[C@H](O)[C@H](C)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.43
ALOX5 P09917 2/20 0.43
PPARG P37231 2/20 0.43
LTB4R Q15722 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
P2RY10 O00398 4/20 0.40
GPR174 Q9BXC1 4/20 0.40
GPR34 Q9UPC5 3/20 0.40

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
SCHEMBL6173327 0.89 HTR1A (0.49) PTGESALOX5PPARGHTR1ADRD2
SCHEMBL6172464 0.82 ABCB1 (0.49) HTR1ADRD2
SCHEMBL15927986 0.80 MEN1 (0.50) PTGESALOX5PPARGLTB4RLTB4R2
SCHEMBL6173226 0.78 RCE1 (0.48) HTR1A
SCHEMBL6171131 0.76 RCE1 (0.42)
SCHEMBL6173227 0.75 SLC6A2 (0.49)
SCHEMBL9472293 0.75 CETP (0.48)
SCHEMBL27297827 0.75 LTB4R (0.54) LTB4RLTB4R2HTR1ADRD2
SCHEMBL6170362 0.73 KMT2A (0.46)
SCHEMBL6134190 0.73 RCE1 (0.40) HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098885-B9 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2005-05-18 EP disclosed
EP-1098885-B1 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2004-11-17 EP disclosed
US-6359145-B1 ADENOSINE DEAMINASE INHIBITOR; ANTIINFLAMMATORY AGENTS; IMMUNOSUPPRESSANT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed
EP-1098885-A1 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-16 EP disclosed
WO-2000005217-A1 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-02-03 WO disclosed