SCHEMBL16175121

SCHEMBL16175121

CC1(C)OB(c2cnc(OC(F)F)c(Cl)c2)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.46
ALPL P05186 1/20 0.35
EGFR P00533 2/20 0.33
LPL P06858 2/20 0.33
LIPG Q9Y5X9 2/20 0.33
PDGFRB P09619 3/20 0.32
KDR P35968 3/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
DGAT1 O75907 2/20 0.32
HCRTR1 O43613 4/20 0.32
HCRTR2 O43614 4/20 0.32
FFAR1 O14842 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
SCHEMBL365161 0.87 AAK1 (0.44) AAK1ALPLEGFRLPLLIPG
SCHEMBL15057283 0.87 AAK1 (0.46) AAK1ALPLLPLLIPGPDGFRB
SCHEMBL16175226 0.85 AAK1 (0.43) AAK1ALPLEGFRLPLLIPG
SCHEMBL367669 0.85 AAK1 (0.43) AAK1ALPLEGFRLPLLIPG
SCHEMBL10198341 0.85 AAK1 (0.42) AAK1ALPLEGFRPDGFRBKDR
SCHEMBL1690230 0.84 AAK1 (0.47) AAK1ALPLEGFRLPLLIPG
SCHEMBL364697 0.84 AAK1 (0.47) AAK1ALPLEGFRLPLLIPG
SCHEMBL10198423 0.84 AAK1 (0.47) AAK1ALPLEGFRLPLLIPG
SCHEMBL16175400 0.84 AAK1 (0.47) AAK1ALPLEGFRLPLLIPG
SCHEMBL10198356 0.83 AAK1 (0.39) AAK1ALPLPDGFRBKDRGSK3A

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-2593431-B1 N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS PFIZER LTD (GB) 2014-11-19 EP disclosed
EP-2593432-B1 N-SULFONYLBENZAMIDE DERIVATIVES USEFUL AS VOLTAGE GATED SODIUM CHANNEL INHIBITORS PFIZER LTD (GB) 2014-10-22 EP disclosed