SCHEMBL7446751

SCHEMBL7446751

O=C(O)N1CCN(C(=O)NCCC2CCNCC2)CC1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 9/20 0.66
TPSD1 Q9BZJ3 9/20 0.66
TPSG1 Q9NRR2 9/20 0.66
NAMPT P43490 1/20 0.49
PRSS1 P07477 4/20 0.47
PRSS2 P07478 4/20 0.47
PRSS3 P35030 4/20 0.47
F2 P00734 3/20 0.46
ITGB3 P05106 7/20 0.44
ITGA2B P08514 7/20 0.44
F2R P25116 5/20 0.44
SIGMAR1 Q99720 1/20 0.43
CHRM4 P08173 1/20 0.43

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
SCHEMBL7446694 0.94 TPSAB1 (0.64) TPSAB1TPSD1TPSG1NAMPTPRSS1
SCHEMBL7447602 0.91 TPSAB1 (0.56) TPSAB1TPSD1TPSG1NAMPTPRSS1
SCHEMBL7447536 0.82 TPSAB1 (0.46) TPSAB1TPSD1TPSG1ITGB3ITGA2B
SCHEMBL7446701 0.81 TPSAB1 (0.72) TPSAB1TPSD1TPSG1NAMPTPRSS1
SCHEMBL7447658 0.80 TPSAB1 (0.76) TPSAB1TPSD1TPSG1PRSS1PRSS2
SCHEMBL4470355 0.79 ITGB3 (0.58) TPSAB1TPSD1TPSG1ITGB3ITGA2B
SCHEMBL7443913 0.78 TPSAB1 (0.61) TPSAB1TPSD1TPSG1NAMPTPRSS1
SCHEMBL7501688 0.77 TPSAB1 (0.54) TPSAB1TPSD1TPSG1NAMPTPRSS1
SCHEMBL1290747 0.77 ITGB3 (0.51) TPSAB1TPSD1TPSG1NAMPTITGB3
SCHEMBL22291286 0.76 ITGB3 (0.46) TPSAB1TPSD1TPSG1ITGB3ITGA2B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934293-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH TRYPTASE ACTIVITY ARRIS PHARMACEUTICAL CORPORATION (US) 1999-08-11 EP claimed
WO-1998004537-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH TRYPTASE ACTIVITY ARRIS PHARMACEUTICAL CORPORATION (US) 1998-02-05 WO claimed
EP-0934293-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH TRYPTASE ACTIVITY ARRIS PHARMACEUTICAL CORPORATION (US) 1999-08-11 EP disclosed
WO-1998004537-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH TRYPTASE ACTIVITY ARRIS PHARMACEUTICAL CORPORATION (US) 1998-02-05 WO disclosed