SCHEMBL13089908

SCHEMBL13089908

CC(C)OC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N(C)C)ccc2Cl)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
ALDH1A1 P00352 7/20 0.51
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 3/20 0.48
NPBWR1 P48145 1/20 0.48
MCHR1 Q99705 1/20 0.48
GPR119 Q8TDV5 1/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
APEX1 P27695 1/20 0.44

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
SCHEMBL2823484 0.87 MAPT (0.53) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL6643103 0.85 TDP1 (0.56) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL2826209 0.74 TDP1 (0.64) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL2826211 0.73 MEN1 (0.46) MAPTKMT2AMEN1CYP2C19GPR119
SCHEMBL1925386 0.71 SMN1; SMN2 (0.47) ALDH1A1KMT2ACYP1A2CYP2C19L3MBTL1
SCHEMBL11560883 0.70 CA1 (0.55) MAPTSMN1; SMN2
SCHEMBL29060789 0.69 MAPT (0.73) MAPTALDH1A1KMT2AMEN1CYP2C19
SCHEMBL11160156 0.68 TDP1 (0.76) ALDH1A1KMT2AMEN1L3MBTL1TDP1
SCHEMBL18711334 0.68 ALDH1A1 (0.75) MAPTALDH1A1KMT2AMEN1CYP2C19
SCHEMBL8054565 0.68 POLB (0.47) MAPTALDH1A1KMT2AMEN1CYP1A2

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-1849469-B1 Arylsulfonamide derivatives for use as CCR3 antagonists in the treatment of inflammatory and immunological disorders AXIKIN PHARMACEUTICALS INC (US) 2010-10-27 EP disclosed