SCHEMBL14306622

SCHEMBL14306622

CC1(N=Nc2ccc(S(C)(=O)=O)cc2)C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.38
▸ POLB P06746 1/20 0.35
▸ GPR55 Q9Y2T6 1/20 0.35
▸ ENPP2 Q13822 2/20 0.33
▸ PTGS2 P35354 8/20 0.31
▸ PTGS1 P23219 5/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ PHLPP2 Q6ZVD8 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ KIF11 P52732 1/20 0.30

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
SCHEMBL14306626 0.79 POLB (0.37) POLBGPR55
SCHEMBL14315017 0.75 POLB (0.34) MAPTPOLBGPR55ALDH1A1
SCHEMBL14315022 0.73 POLB (0.37) POLBGPR55
SCHEMBL14315019 0.71 POLB (0.43) POLBGPR55SMN1; SMN2
SCHEMBL5355231 0.62 ENPP2 (0.75) MAPTPOLBENPP2PTGS2PTGS1
SCHEMBL5355235 0.62 ENPP2 (0.75) MAPTPOLBENPP2PTGS2PTGS1
SCHEMBL13886742 0.62 POLB (0.53) MAPTPOLBGPR55ALDH1A1SMN1; SMN2
SCHEMBL2376239 0.61 ENPP2 (0.72) ENPP2PTGS2
SCHEMBL21882103 0.61 MAPT (0.44) MAPTPOLBENPP2PTGS2CA12
SCHEMBL7056902 0.60 ENPP2 (0.52) MAPTENPP2PTGS2CA12CA2

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
US-7314692-B2 Phenylazomethylene-cyclohexadienone derivatives comprising electron withdrawing group and electrophotographic photoreceptor comprising the derivatives SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-01-01 — — US disclosed
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