SCHEMBL14367371

SCHEMBL14367371

N=C(N)c1ccc(OCCCNCCNCCC(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.60
PRSS1 P07477 6/20 0.58
TMPRSS2 O15393 2/20 0.58
ITGB3 P05106 1/20 0.57
ITGA2B P08514 1/20 0.57
PRMT1 Q99873 3/20 0.56
F2 P00734 2/20 0.56
ST14 Q9Y5Y6 2/20 0.56
PLAU P00749 1/20 0.56
PRMT5 O14744 1/20 0.56
SLC22A2 O15244 1/20 0.56
SLC22A1 O15245 1/20 0.56
PTP4A3 O75365 1/20 0.56
SLC22A3 O75751 1/20 0.56
F10 P00742 1/20 0.56
PLG P00747 1/20 0.56
S100B P04271 1/20 0.56
CHRM2 P08172 1/20 0.56
CHRM4 P08173 1/20 0.56
CHRM5 P08912 1/20 0.56

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
Hydrochloric Acid SCHEMBL1713994 0.99 PRSS1 (0.59) LTA4HPRSS1TMPRSS2ITGB3ITGA2B
SCHEMBL14367377 0.95 ITGB3 (0.60) LTA4HPRSS1TMPRSS2ITGB3ITGA2B
Hydrochloric Acid SCHEMBL5624225 0.93 ITGB3 (0.59) LTA4HPRSS1TMPRSS2ITGB3ITGA2B
SCHEMBL12461376 0.92 ITGB3 (0.68) LTA4HPRSS1TMPRSS2ITGB3ITGA2B
Hydrochloric Acid SCHEMBL5623271 0.91 ITGB3 (0.67) PRSS1TMPRSS2ITGB3ITGA2BPRMT1
SCHEMBL14367353 0.91 ITGB3 (0.70) LTA4HPRSS1TMPRSS2ITGB3ITGA2B
Hydrochloric Acid SCHEMBL1714301 0.90 ITGB3 (0.68) PRSS1TMPRSS2ITGB3ITGA2BPRMT1
SCHEMBL12461520 0.89 PRSS1 (0.73) PRSS1TMPRSS2PRMT1F2ST14
SCHEMBL12461746 0.88 ITGB3 (0.70) PRSS1TMPRSS2ITGB3ITGA2BPRMT1
Hydrochloric Acid SCHEMBL5623183 0.87 PRSS1 (0.74) PRSS1TMPRSS2PRMT1F2ST14

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-7291617-B2 Arylamidine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-06 US disclosed
US-7291617-B2 Arylamidine derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-06 US disclosed