SCHEMBL17255673

SCHEMBL17255673

CCOC(=O)c1c(C)nn(-c2ccccc2O)c1C

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.74
PDE4D Q08499 4/20 0.69
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA7 P43166 1/20 0.54
CA9 Q16790 1/20 0.54
CA14 Q9ULX7 1/20 0.54
NPSR1 Q6W5P4 2/20 0.53
P2RY12 Q9H244 2/20 0.50
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 2/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL4316847 0.85 PDE4B (1.00) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL6070491 0.85 PDE4B (0.73) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL30900068 0.84 PDE4B (0.71) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL6069548 0.82 PDE4D (1.00) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL16857585 0.81 LMNA (0.56) PDE4BPDE4DNPSR1RAB9ANPC1
SCHEMBL6070168 0.81 PDE4B (0.67) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL20604097 0.80 PDE4B (0.62) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL123446 0.77 PDE4D (0.67) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL6070059 0.76 PDE4D (0.80) PDE4BPDE4DNPSR1P2RY12RAB9A
SCHEMBL26659337 0.76 PDE4D (0.66) PDE4BPDE4DNPSR1P2RY12RAB9A

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
EP-2669274-B1 TOPICAL ANTIFUNGAL AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2015-11-18 EP claimed