SCHEMBL8005964

SCHEMBL8005964

COc1c(O)cccc1CC1CCCCC1=O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
CA4 P22748 4/20 0.54
CA6 P23280 4/20 0.54
CETP P11597 1/20 0.42
PTGS1 P23219 9/20 0.40
PTGS2 P35354 7/20 0.40
OPRK1 P41145 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
DRD2 P14416 1/20 0.38
DRD1 P21728 1/20 0.38
DRD3 P35462 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
MAPK1 P28482 1/20 0.37

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
SCHEMBL11790076 0.84 CA1 (0.60) CA1CA2CA4CA6HTT
SCHEMBL7999409 0.83 CA1 (0.53) CA1CA2CA4CA6PTGS1
SCHEMBL4754011 0.82 KDM4E (0.49) CA1CA2CA4CA6PTGS1
SCHEMBL4726814 0.82 KDM4E (0.49) CA1CA2CA4CA6PTGS1
SCHEMBL11793897 0.81 CA1 (0.53) CA1CA2CA4CA6PTGS1
SCHEMBL11795780 0.80 CA1 (0.50) CA1CA2CA4CA6PTGS1
SCHEMBL19050078 0.78 CA1 (0.63) CA1CA2CA4CA6PTGS1
SCHEMBL8005760 0.78 CA1 (0.53) CA1CA2CA4CA6PTGS1
SCHEMBL15874849 0.78 CA1 (0.59) CA1CA2CA4CA6PTGS1
SCHEMBL7486281 0.78 CA1 (0.59) CA1CA2CA4CA6PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0989975-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed
WO-2000016760-A2 NEW USE OF PROSTAGLANDIN E2 ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-03-30 WO disclosed
WO-1998055468-A1 OXAZOLE COMPOUNDS USEFUL AS PGE2 AGONISTS AND ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-10 WO disclosed