SCHEMBL16306391

SCHEMBL16306391

Bc1c(F)cc(-c2cccc(Cl)c2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ FYN P06241 1/20 0.41
▸ CYP1A1 P04798 2/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP1B1 Q16678 2/20 0.39
▸ MAPK10 P53779 3/20 0.39
▸ NOTUM Q6P988 1/20 0.39
▸ PDGFRB P09619 1/20 0.39
▸ KIT P10721 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ SCN9A Q15858 2/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ ESR2 Q92731 1/20 0.37

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
SCHEMBL16290631 0.82 TSHR (0.43) TSHRMAPTNPC1SMN1; SMN2MEN1
SCHEMBL16290972 0.78 FYN (0.41) TSHRMAPTNPC1SMN1; SMN2MEN1
SCHEMBL16303540 0.76 TSHR (0.43) TSHRMAPTNPC1SMN1; SMN2MEN1
SCHEMBL16311812 0.75 MAPK10 (0.44) TSHRMAPTMEN1KMT2AFYN
SCHEMBL3790825 0.73 CTSA (0.44) TSHRMAPTNPC1SMN1; SMN2MEN1
SCHEMBL16290889 0.70 CYP1A1 (0.56) KMT2ACYP1A1CYP1A2CYP1B1NOTUM
SCHEMBL8066084 0.69 PDE4B (0.51) TSHRMAPTNPC1SMN1; SMN2MEN1
SCHEMBL6315146 0.69 PDE4B (0.46) TSHRMAPTNPC1SMN1; SMN2MEN1
SCHEMBL16290880 0.69 MAPK10 (0.44) TSHRMAPTNPC1SMN1; SMN2FYN
SCHEMBL12999936 0.68 ESR2 (0.58) TP53ESR2

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
WO-2014201206-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. (US) 2014-12-18 — — WO disclosed
WO-2014201173-A1 BICYCLIC SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. (US) 2014-12-18 — — WO disclosed
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