SCHEMBL4963671

SCHEMBL4963671

CCN(CC)C(=O)c1cccs1.[KH]

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.68
▸ ALDH1A1 P00352 5/20 0.62
▸ RAB9A P51151 4/20 0.62
▸ NPC1 O15118 3/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ CES2 O00748 1/20 0.55
▸ CES1 P23141 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ KIF11 P52732 5/20 0.53
▸ OPRM1 P35372 1/20 0.53
▸ OPRD1 P41143 1/20 0.53
▸ LMNA P02545 2/20 0.50
▸ POLB P06746 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ DAO P14920 1/20 0.48
▸ HPGD P15428 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ ALOX15 P16050 1/20 0.47

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
SCHEMBL6938391 0.98 USP2 (0.69) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL3455402 0.84 USP2 (0.79) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL17285675 0.81 CES2 (0.55) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL27284450 0.81 USP2 (0.55) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL23386742 0.80 USP2 (0.54) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL18413785 0.79 USP2 (0.52) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL5160857 0.77 ERCC5 (0.56) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL30038588 0.77 ALDH1A1 (0.51) USP2ALDH1A1RAB9ANPC1KDM4E
SCHEMBL827527 0.76 CES2 (0.64) USP2ALDH1A1RAB9ANPC1CES2
SCHEMBL10754142 0.76 USP2 (0.50) USP2ALDH1A1RAB9ANPC1KDM4E

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-1904472-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS Nissan Chemical Industries, Ltd. (JP) 2008-04-02 — — EP disclosed
WO-2007010954-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-01-25 — — WO disclosed
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