SCHEMBL698029

SCHEMBL698029

COc1cc(C(O)c2ncc[nH]2)c(C)cc1C

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F2RL1 P55085 19/20 0.45
SMPD3 Q9NY59 1/20 0.42

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
SCHEMBL697302 0.84 ADRA2A (0.43) F2RL1SMPD3
SCHEMBL3530179 0.82 SMPD3 (0.40) F2RL1SMPD3
SCHEMBL3530177 0.77 SMPD3 (0.40) F2RL1SMPD3
SCHEMBL9501488 0.70 F2RL1 (0.46) F2RL1
SCHEMBL24787748 0.69 GAA (0.44)
SCHEMBL696724 0.69 F2RL1 (0.60) F2RL1
SCHEMBL697771 0.69 SMPD3 (0.42) SMPD3
SCHEMBL11046355 0.66 F2RL1 (0.57) F2RL1
SCHEMBL697260 0.66 NPC1 (0.50) F2RL1SMPD3
SCHEMBL24371606 0.65 GAA (0.50)

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
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed