SCHEMBL7997563

SCHEMBL7997563

Cc1nccc(Oc2ccccc2)c1C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.43
PTGS2 P35354 3/20 0.43
LTA4H P09960 3/20 0.41
TSHR P16473 1/20 0.41
PIK3C3 Q8NEB9 1/20 0.39
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GCK P35557 1/20 0.38
FGFR2 P21802 1/20 0.38
CYP2A6 P11509 1/20 0.38

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
SCHEMBL10666290 0.83 PTGS1 (0.42) PTGS1PTGS2LTA4HTSHRPIK3C3
SCHEMBL25873402 0.81 MEN1 (0.47) TSHRCCNCCDK8MAPTSMN1; SMN2
SCHEMBL2084341 0.78 ADORA2A (0.51) PTGS1PTGS2LTA4HTSHRHTT
SCHEMBL7995444 0.78 TTR (0.41) PTGS1PTGS2LTA4HMAPTFGFR2
SCHEMBL7995752 0.78 TTR (0.42) PTGS1PTGS2LTA4HTSHRMAPT
SCHEMBL10006897 0.77 LTA4H (0.55) LTA4HTSHRKDM4ELMNAHTT
SCHEMBL18418110 0.77 SLC6A4 (0.42) CCNCCDK8MAPTKDM4ELMNA
SCHEMBL10388637 0.76 ADORA2A (0.49) PTGS1PTGS2LTA4HTSHRKDM4E
SCHEMBL25873407 0.75 HTT (0.50) MAPTLMNAHTTSMN1; SMN2
SCHEMBL3762380 0.74 LTA4H (0.52) LTA4HTSHRMAPTLMNAHTT

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
CN-1213658-C Pyridinecarboxamide derivative and pest control agent containing same as active ingredient MEIJI SEIKA KAISHA (JP) 2005-08-10 CN disclosed
CN-1329596-A Pyridinecarboxamide derivative and pest control agent containing same as active ingredient MEIJI SEIKA KAISHA (JP) 2002-01-02 CN disclosed
WO-2001034578-A1 COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY ASTRAZENECA AB (SE) 2001-05-17 WO disclosed