SCHEMBL14367459

SCHEMBL14367459

N=C(N)c1ccc(OCCCNCCNCCCOc2cccc(C(=N)N)c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 10/20 0.68
F2 P00734 1/20 0.68
PLG P00747 1/20 0.68
PRSS2 P07478 1/20 0.68
C1S P09871 1/20 0.68
PRSS3 P35030 1/20 0.68
F10 P00742 2/20 0.67
TMPRSS2 O15393 1/20 0.58

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 SCHEMBL5623120 0.99 PRSS1 (0.69) PRSS1F2PLGPRSS2C1S
SCHEMBL12461520 0.89 PRSS1 (0.73) PRSS1F2PLGPRSS2PRSS3
SCHEMBL14599540 0.87 PRSS1 (0.88) PRSS1F2PLGPRSS2C1S
SCHEMBL12461759 0.87 PRSS1 (0.71) PRSS1F2PLGPRSS2PRSS3
Hydrochloric Acid SCHEMBL5623183 0.87 PRSS1 (0.74) PRSS1F2PLGPRSS2PRSS3
SCHEMBL12460737 0.87 PRSS1 (0.76) PRSS1F2PLGPRSS2PRSS3
Hydrochloric Acid SCHEMBL5623287 0.86 PRSS1 (0.72) PRSS1F2PLGF10TMPRSS2
SCHEMBL12461903 0.86 PRSS1 (0.69) PRSS1F2PLGF10TMPRSS2
Hydrochloric Acid SCHEMBL5623136 0.85 PRSS1 (0.77) PRSS1F2PLGPRSS2PRSS3
SCHEMBL14367440 0.85 PRSS1 (0.73) PRSS1F2PLGF10TMPRSS2

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