SCHEMBL14132246

SCHEMBL14132246

N=C(N)c1cccc(NC(=O)[C@H](Cc2ccc(OC3CCNCC3)cc2)NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 12/20 0.51
▸ ST14 Q9Y5Y6 11/20 0.51
▸ F10 P00742 11/20 0.51
▸ PLAU P00749 10/20 0.51
▸ PLG P00747 10/20 0.51
▸ ITGB3 P05106 4/20 0.49
▸ ITGA2B P08514 4/20 0.49
▸ TMPRSS6 Q8IU80 3/20 0.49
▸ HPN P05981 1/20 0.48
▸ ITGAV P06756 2/20 0.46
▸ ITGB1 P05556 1/20 0.45
▸ ITGB5 P18084 1/20 0.45

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
Trifluoroacetic Acid SCHEMBL3898272 0.96 F2 (0.56) F2ST14F10PLAUPLG
SCHEMBL3909321 0.85 ST14 (0.62) F2ST14F10PLAUPLG
Trifluoroacetic Acid SCHEMBL3898518 0.85 F2 (0.53) F2ST14F10PLAUPLG
SCHEMBL14132244 0.82 F10 (0.47) F2ST14F10PLAUPLG
SCHEMBL14132239 0.82 F10 (0.46) F2ST14F10PLAUPLG
SCHEMBL14132285 0.82 F10 (0.46) F2ST14F10PLAUPLG
Trifluoroacetic Acid SCHEMBL3894631 0.79 F2 (0.48) F2ST14F10PLAUPLG
Trifluoroacetic Acid SCHEMBL3900418 0.79 F2 (0.46) F2ST14F10PLAUPLG
Trifluoroacetic Acid SCHEMBL3900322 0.79 F2 (0.46) F2ST14F10PLAUPLG
SCHEMBL14132069 0.78 F10 (0.45) F2ST14F10PLAUPLG

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
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 — — US disclosed
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 — — US disclosed
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